data_1r8p_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 1r8p _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 ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.251 0.548 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.44 122.39 61.24 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.508 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -68.96 146.52 65.44 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.063 1.56 . . . . 0.0 110.197 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.422 ' CG1' ' O ' ' A' ' 4' ' ' ILE . 1.7 pp -143.98 117.38 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.168 -0.957 . . . . 0.0 110.364 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -94.13 153.38 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 109.999 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.557 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -134.96 117.59 15.96 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.0 109.85 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.66 148.65 35.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.311 -0.868 . . . . 0.0 110.199 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.516 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 16.6 tttm -142.72 168.1 20.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 110.225 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.516 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 151.11 -156.38 26.64 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.14 127.57 32.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.238 -1.154 . . . . 0.0 110.342 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.19 -27.03 5.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.099 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -77.75 -45.67 23.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.279 -0.888 . . . . 0.0 110.29 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.434 ' O ' HD11 ' A' ' 17' ' ' LEU . 28.2 m -57.89 -21.76 44.88 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.163 -0.961 . . . . 0.0 110.086 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.429 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 30.6 mt -76.62 -29.69 56.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.872 . . . . 0.0 110.343 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -60.18 -39.46 86.54 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.229 -0.919 . . . . 0.0 110.59 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -69.91 -40.31 75.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.249 -0.907 . . . . 0.0 110.7 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.434 HD11 ' O ' ' A' ' 13' ' ' THR . 14.5 mt -58.51 -49.55 76.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.143 -0.973 . . . . 0.0 110.334 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.577 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 46.6 ttt-85 -45.04 -37.86 4.45 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.184 -0.948 . . . . 0.0 110.796 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.443 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 87.5 t80 -64.56 -41.77 96.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.103 -0.998 . . . . 0.0 110.344 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -57.67 -36.5 72.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.0 109.871 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.577 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 5.8 m-30 -66.79 -18.12 65.22 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.093 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 28.2 mmtt -63.31 -48.24 78.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.954 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.5 mmtt -74.83 -23.88 58.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.41 ' HB3' HD13 ' A' ' 27' ' ' LEU . 36.7 m170 -95.23 33.92 1.49 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.967 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.536 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 21.2 p -56.75 -24.63 51.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.257 -0.902 . . . . 0.0 110.07 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.426 ' CG2' ' O ' ' A' ' 26' ' ' THR . 14.1 t -96.9 54.09 1.26 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 109.771 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.41 HD13 ' HB3' ' A' ' 24' ' ' HIS . 12.4 mt -147.78 -32.02 0.28 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -0.851 . . . . 0.0 110.755 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.536 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 9.2 p90 -108.76 167.51 10.01 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.928 -1.108 . . . . 0.0 110.012 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 m -100.66 -36.56 9.09 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.091 -1.006 . . . . 0.0 110.88 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.1 118.85 2.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.08 -1.013 . . . . 0.0 110.728 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -89.94 136.06 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.266 -0.896 . . . . 0.0 109.935 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.57 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 28.4 p -96.36 149.83 21.26 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.071 -1.018 . . . . 0.0 110.303 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.31 162.02 8.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.22 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -68.0 127.88 34.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.328 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.574 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 40.9 p-90 -146.14 179.95 7.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.198 -0.939 . . . . 0.0 109.798 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.579 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 26.7 t-80 -162.71 173.82 13.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.863 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.579 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 55.9 m95 -78.6 93.35 4.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.401 -0.812 . . . . 0.0 109.834 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.6 t . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.312 -0.868 . . . . 0.0 110.42 -179.687 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.446 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 121.382 0.611 . . . . 0.0 110.559 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.446 HG13 ' C ' ' A' ' 47' ' ' ALA . 40.6 mt -142.49 146.86 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.892 . . . . 0.0 110.115 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.21 178.18 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.185 -0.947 . . . . 0.0 110.25 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.543 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 53.9 m -145.91 151.18 37.43 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.267 -0.896 . . . . 0.0 110.159 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.499 ' N ' HG22 ' A' ' 50' ' ' THR . 0.3 OUTLIER -135.72 128.91 31.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -0.998 . . . . 0.0 110.091 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -97.91 134.51 40.94 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.301 -0.874 . . . . 0.0 110.642 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.521 ' OH ' ' CG ' ' A' ' 62' ' ' PHE . 54.8 m-85 -112.72 151.51 30.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.298 -0.876 . . . . 0.0 110.053 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -76.7 -8.52 57.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 110.622 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.8 p -169.55 160.94 9.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.05 -1.031 . . . . 0.0 110.561 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.2 -41.94 80.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.203 -0.936 . . . . 0.0 109.932 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.48 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 51.7 t-105 -53.51 -52.39 59.77 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 61.7 tt0 -58.74 -30.56 67.59 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.188 -0.945 . . . . 0.0 109.685 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.1 -48.97 79.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.392 -0.817 . . . . 0.0 110.557 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.537 ' OD1' ' N ' ' A' ' 61' ' ' GLN . 2.5 p30 -61.17 -26.54 67.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.087 -1.008 . . . . 0.0 110.315 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.537 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 67.1 mt-30 -65.95 -52.03 53.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.151 -0.968 . . . . 0.0 109.97 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.521 ' CG ' ' OH ' ' A' ' 53' ' ' TYR . 5.7 t80 -55.53 -46.32 77.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 109.718 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.3 mt -59.75 -21.87 61.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.33 -0.856 . . . . 0.0 110.198 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.91 -17.56 29.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 110.076 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -94.65 -14.74 24.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.312 -0.867 . . . . 0.0 110.351 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.4 HG21 ' CZ ' ' A' ' 62' ' ' PHE . 20.1 m -130.37 134.81 61.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -0.908 . . . . 0.0 110.137 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.5 tptp -86.52 120.05 27.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.205 -0.934 . . . . 0.0 110.322 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.433 ' O ' ' C ' ' A' ' 69' ' ' PRO . 4.8 mm -88.96 103.6 5.94 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.967 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.533 ' HG2' ' CG1' ' A' ' 72' ' ' ILE . 46.0 Cg_endo -39.9 154.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.094 1.576 . . . . 0.0 110.418 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.413 ' HB3' ' HE3' ' A' ' 70' ' ' LYS . 13.6 mtpp -70.35 -14.86 62.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 0.0 110.459 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -84.66 -19.32 33.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.361 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.533 ' CG1' ' HG2' ' A' ' 69' ' ' PRO . 23.8 mt -93.81 123.59 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.6 m -94.7 136.6 34.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.458 -0.776 . . . . 0.0 110.416 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.48 HG11 ' N ' ' A' ' 75' ' ' SER . 92.9 t -90.73 171.99 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.565 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.557 ' HB2' ' CB ' ' A' ' 6' ' ' HIS . 0.4 OUTLIER -142.45 152.82 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.387 -0.821 . . . . 0.0 110.661 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' B' ' 80' ' ' SER . 63.5 p -132.97 135.4 45.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.273 -0.892 . . . . 0.0 110.15 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.502 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -174.39 -173.63 40.53 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.502 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 50.2 m-85 -147.65 151.56 36.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.167 -1.196 . . . . 0.0 110.399 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.439 ' CE ' ' HE1' ' B' ' 79' ' ' MET . 25.5 mtt -119.78 174.84 6.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.182 -0.949 . . . . 0.0 110.287 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.453 ' C ' ' CG1' ' A' ' 81' ' ' ILE . 0.1 OUTLIER -140.69 108.72 5.73 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.324 -0.86 . . . . 0.0 109.836 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.453 ' CG1' ' C ' ' A' ' 80' ' ' SER . 23.3 mt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.23 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mtm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.226 0.536 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.5 122.17 61.64 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.161 -0.962 . . . . 0.0 110.44 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.5 Cg_endo -68.79 146.86 67.62 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.978 1.515 . . . . 0.0 110.071 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.417 HD11 ' O ' ' B' ' 4' ' ' ILE . 1.7 pp -144.12 117.22 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.118 -0.989 . . . . 0.0 110.297 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 53.6 t -94.06 152.63 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.268 -0.895 . . . . 0.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.581 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 0.0 OUTLIER -134.45 117.75 16.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.938 179.9 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.86 148.81 36.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.284 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.502 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 16.5 tttm -142.59 168.34 19.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.502 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 151.12 -156.76 26.84 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -64.98 127.31 31.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -1.188 . . . . 0.0 110.293 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.09 -26.86 4.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.299 -0.876 . . . . 0.0 110.088 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -77.6 -45.92 23.74 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.19 -0.944 . . . . 0.0 110.219 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.439 ' O ' HD11 ' B' ' 17' ' ' LEU . 28.1 m -57.96 -21.13 42.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.26 -0.9 . . . . 0.0 110.089 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.448 ' HA ' ' CD1' ' B' ' 17' ' ' LEU . 31.7 mt -77.24 -29.79 54.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.247 -0.908 . . . . 0.0 110.246 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -60.13 -38.84 84.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.879 . . . . 0.0 110.582 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.7 t -70.02 -40.19 75.35 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.192 -0.943 . . . . 0.0 110.8 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.448 ' CD1' ' HA ' ' B' ' 14' ' ' LEU . 14.0 mt -58.86 -50.13 75.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.128 -0.982 . . . . 0.0 110.349 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.568 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 46.5 ttt-85 -44.8 -37.26 3.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.924 . . . . 0.0 110.767 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.448 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 87.7 t80 -64.97 -41.56 95.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.991 -1.068 . . . . 0.0 110.239 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 mtt180 -58.21 -36.6 73.37 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.212 -0.93 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.568 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 5.8 m-30 -66.54 -17.8 65.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.1 mmtt -63.39 -48.54 77.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.203 -0.936 . . . . 0.0 110.035 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -74.66 -23.81 58.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.264 -0.898 . . . . 0.0 109.638 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.409 ' HB3' ' CD1' ' B' ' 27' ' ' LEU . 36.2 m170 -95.23 34.05 1.47 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.347 -0.846 . . . . 0.0 109.832 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.51 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.2 p -56.74 -24.84 52.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.309 -0.87 . . . . 0.0 110.015 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.43 ' O ' ' CG2' ' B' ' 26' ' ' THR . 14.0 t -96.71 54.06 1.29 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.35 -0.844 . . . . 0.0 109.77 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.409 ' CD1' ' HB3' ' B' ' 24' ' ' HIS . 12.3 mt -147.76 -32.02 0.28 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.335 -0.853 . . . . 0.0 110.788 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.51 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 9.1 p90 -108.38 167.53 9.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.864 -1.148 . . . . 0.0 110.04 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 18.9 m -100.54 -36.88 9.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.193 -0.942 . . . . 0.0 110.698 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.87 118.93 2.8 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.054 -1.029 . . . . 0.0 110.733 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -89.95 136.81 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.296 -0.877 . . . . 0.0 109.827 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.574 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 26.8 p -97.37 150.46 20.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.135 -0.978 . . . . 0.0 110.451 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.36 161.74 8.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.368 -0.833 . . . . 0.0 110.43 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -68.15 127.55 33.31 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 110.365 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.57 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 39.8 p-90 -146.26 -179.97 7.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.66 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.575 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 27.5 t-80 -162.57 174.37 12.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.931 -1.105 . . . . 0.0 110.67 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.575 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 57.1 m95 -78.6 93.54 4.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.484 -0.76 . . . . 0.0 109.806 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 13.9 t . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.27 -0.894 . . . . 0.0 110.333 -179.698 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.455 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 121.359 0.599 . . . . 0.0 110.66 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.455 HG13 ' C ' ' B' ' 47' ' ' ALA . 38.7 mt -142.75 147.24 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 110.125 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.95 178.26 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.219 -0.926 . . . . 0.0 110.281 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.581 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 53.1 m -145.96 151.75 38.3 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.246 -0.909 . . . . 0.0 110.105 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.507 ' N ' HG22 ' B' ' 50' ' ' THR . 0.3 OUTLIER -136.08 129.12 31.4 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.159 -0.963 . . . . 0.0 110.061 179.863 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 7.3 m -97.95 134.58 40.87 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.28 -0.888 . . . . 0.0 110.602 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.51 ' OH ' ' CG ' ' B' ' 62' ' ' PHE . 52.8 m-85 -112.84 151.6 30.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.315 -0.865 . . . . 0.0 110.065 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -76.31 -9.2 58.46 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.191 -0.943 . . . . 0.0 110.637 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 26.1 p -169.51 160.19 8.95 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.186 -0.946 . . . . 0.0 110.468 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.81 -42.15 86.37 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.196 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . 0.482 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 50.4 t-105 -53.53 -52.34 59.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.243 -0.911 . . . . 0.0 109.669 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.467 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 63.1 tt0 -58.85 -30.11 67.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.243 -0.911 . . . . 0.0 109.721 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.29 -49.18 78.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 110.464 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' B' ' 61' ' ' GLN . 2.3 p30 -61.18 -26.61 67.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.093 -1.005 . . . . 0.0 110.36 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.53 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 67.2 mt-30 -65.86 -52.09 53.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.19 -0.944 . . . . 0.0 109.851 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.51 ' CG ' ' OH ' ' B' ' 53' ' ' TYR . 5.3 t80 -55.47 -46.3 76.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.824 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.2 mt -59.59 -22.07 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.0 110.136 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.71 -17.62 29.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.146 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -94.68 -13.96 25.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.293 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.403 HG21 ' CZ ' ' B' ' 62' ' ' PHE . 22.0 m -131.01 134.63 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.188 -0.945 . . . . 0.0 110.181 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -86.3 120.03 27.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.43 ' O ' ' C ' ' B' ' 69' ' ' PRO . 4.9 mm -89.02 103.76 6.3 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.979 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.529 ' HG2' ' CG1' ' B' ' 72' ' ' ILE . 45.8 Cg_endo -40.38 154.5 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.076 1.566 . . . . 0.0 110.495 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -70.5 -14.76 62.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.886 . . . . 0.0 110.486 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 28.4 m -84.58 -19.05 33.7 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.154 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.529 ' CG1' ' HG2' ' B' ' 69' ' ' PRO . 27.1 mt -94.32 123.71 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.33 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 24.3 m -94.8 136.64 34.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.38 -0.825 . . . . 0.0 110.495 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.485 HG11 ' N ' ' B' ' 75' ' ' SER . 99.4 t -90.79 172.07 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.264 -0.898 . . . . 0.0 110.602 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' SER . . . . . 0.561 ' HB2' ' CB ' ' B' ' 6' ' ' HIS . 0.4 OUTLIER -142.29 153.56 44.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.358 -0.839 . . . . 0.0 110.658 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' THR . . . . . 0.443 ' O ' ' HB3' ' A' ' 80' ' ' SER . 52.5 p -133.56 135.74 44.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . 0.529 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -174.61 -173.61 40.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.529 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 48.9 m-85 -147.81 149.92 33.24 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -1.117 . . . . 0.0 110.33 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.439 ' HE1' ' CE ' ' A' ' 79' ' ' MET . 26.0 mtt -118.69 173.22 6.98 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.226 -0.921 . . . . 0.0 110.351 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.454 ' C ' HG13 ' B' ' 81' ' ' ILE . 0.1 OUTLIER -139.43 107.95 5.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 110.086 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.484 HD13 ' OG ' ' A' ' 75' ' ' SER . 29.7 mt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.169 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.4 mmm . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.327 0.584 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.43 ' O ' ' CG2' ' A' ' 2' ' ' THR . 14.8 t -88.42 125.96 61.84 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.903 . . . . 0.0 110.413 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.559 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -63.45 152.29 80.81 Favored 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 124.124 1.592 . . . . 0.0 110.209 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.447 HG22 ' C ' ' A' ' 3' ' ' PRO . 11.1 pt -144.16 164.04 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.211 -0.931 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.471 ' O ' HG22 ' A' ' 50' ' ' THR . 41.3 t -146.14 136.88 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.159 -0.963 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.594 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 0.3 OUTLIER -105.2 131.38 52.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 109.599 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.473 ' O ' HG22 ' A' ' 48' ' ' ILE . 0.4 OUTLIER -122.45 139.66 53.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.139 -0.976 . . . . 0.0 110.771 -179.407 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.489 ' CG ' ' N ' ' A' ' 9' ' ' GLY . 80.6 tttt -142.3 170.85 14.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 110.164 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.489 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 153.44 -160.55 29.28 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.619 -1.393 . . . . 0.0 109.619 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.45 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 47.0 t0 -64.86 130.54 43.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -1.143 . . . . 0.0 110.336 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.1 -30.77 11.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.302 -0.873 . . . . 0.0 110.464 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -83.61 -48.39 10.26 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.263 -0.898 . . . . 0.0 110.527 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.45 ' HB ' ' HB3' ' A' ' 10' ' ' ASP . 91.7 m -57.88 -14.96 7.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 110.494 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.457 ' HA ' HD11 ' A' ' 17' ' ' LEU . 64.2 mt -82.48 -32.42 28.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 110.309 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -59.23 -36.62 75.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.239 -0.913 . . . . 0.0 110.031 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.422 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.7 t -70.11 -34.67 73.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.288 -0.883 . . . . 0.0 110.048 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.457 HD11 ' HA ' ' A' ' 14' ' ' LEU . 13.3 mt -58.77 -50.62 73.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.917 . . . . 0.0 109.939 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.562 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 34.5 ttt180 -46.23 -30.65 2.09 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.283 -0.885 . . . . 0.0 109.883 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.474 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 28.2 t80 -65.01 -46.55 80.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.399 -0.813 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -34.29 73.63 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.225 -0.922 . . . . 0.0 110.316 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.5 m-30 -66.38 -22.6 66.25 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 110.377 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 29.5 mmtt -63.62 -29.93 71.11 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.244 -0.91 . . . . 0.0 110.336 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -74.84 -47.75 28.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 16.0 m-70 -95.15 41.3 1.1 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.869 . . . . 0.0 109.965 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.547 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 24.5 p -56.8 -19.15 15.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 110.19 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.7 m -97.17 6.43 48.48 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.327 -0.858 . . . . 0.0 110.284 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.464 ' HB2' ' HB3' ' A' ' 24' ' ' HIS . 0.8 OUTLIER -92.19 -7.67 47.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.291 -0.88 . . . . 0.0 110.187 -179.754 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.547 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 7.3 p90 -141.7 -176.76 4.88 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.027 -179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 m -94.84 -62.83 1.25 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.921 . . . . 0.0 109.191 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.18 143.86 18.25 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.929 -1.107 . . . . 0.0 108.72 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.467 HG11 ' O ' ' A' ' 31' ' ' VAL . 7.7 p -90.02 110.76 22.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.9 0 O-C-N 121.639 -0.663 . . . . 0.0 110.325 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.585 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -53.24 146.15 12.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.213 -0.929 . . . . 0.0 110.009 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.557 ' HB2' ' CG2' ' B' ' 38' ' ' THR . 7.0 t -60.9 160.82 9.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 m -67.75 122.07 17.31 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.525 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.579 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 25.4 p-90 -147.1 166.7 26.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 109.83 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.516 ' CD2' HG13 ' A' ' 48' ' ' ILE . 11.2 t-80 -162.58 -173.52 3.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.042 -1.036 . . . . 0.0 110.779 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.583 ' CH2' HG23 ' B' ' 52' ' ' THR . 19.4 m95 -79.53 101.67 8.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.501 -0.75 . . . . 0.0 110.379 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.546 ' CG2' ' HB2' ' B' ' 33' ' ' SER . 1.7 t . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.401 -0.812 . . . . 0.0 110.017 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.219 0.533 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.516 HG13 ' CD2' ' A' ' 36' ' ' HIS . 2.7 mt -140.55 155.6 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.275 -0.891 . . . . 0.0 110.297 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.9 t -138.75 118.47 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.385 -0.822 . . . . 0.0 110.394 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.594 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 86.9 m -94.3 158.13 15.72 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.251 -0.905 . . . . 0.0 110.314 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.97 134.24 38.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.274 -0.892 . . . . 0.0 110.112 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.523 HG23 ' CH2' ' B' ' 37' ' ' TRP . 0.9 OUTLIER -96.38 123.94 40.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.228 -0.92 . . . . 0.0 110.341 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.559 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 58.5 m-85 -103.32 146.83 27.88 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.351 -0.843 . . . . 0.0 109.85 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.09 -8.25 58.81 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.203 -0.935 . . . . 0.0 110.658 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.9 p -171.15 134.11 0.9 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.961 . . . . 0.0 110.374 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.501 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 44.4 mt-10 -50.08 -37.54 34.16 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.249 -0.907 . . . . 0.0 109.988 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 35.5 t-105 -53.83 -58.87 5.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.076 -1.015 . . . . 0.0 109.799 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -58.47 -28.74 65.62 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.161 -0.962 . . . . 0.0 110.337 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.501 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 53.6 ttp180 -59.56 -48.38 81.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.154 -0.967 . . . . 0.0 110.984 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.519 ' OD1' ' N ' ' A' ' 61' ' ' GLN . 1.1 p30 -60.93 -33.67 73.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.093 -1.004 . . . . 0.0 110.741 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.519 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 57.5 mt-30 -65.65 -47.57 75.12 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.148 -0.97 . . . . 0.0 110.271 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.486 ' CD1' ' OH ' ' A' ' 53' ' ' TYR . 36.2 t80 -55.8 -65.24 0.63 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.38 -0.825 . . . . 0.0 110.664 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 60' ' ' ASP . 3.0 pp -59.39 -18.33 37.88 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 3.6 t -81.84 -20.68 38.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 0.0 110.128 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.52 -73.03 0.6 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.273 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.3 m -48.14 130.18 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.113 -0.992 . . . . 0.0 109.992 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.7 108.43 6.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.179 -0.95 . . . . 0.0 110.492 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 30.9 mt -89.21 121.37 69.54 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.377 -0.827 . . . . 0.0 110.09 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -56.26 179.01 0.1 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 123.899 1.473 . . . . 0.0 110.528 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -92.19 -12.43 32.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 110.133 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.3 m -84.62 -16.69 41.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.249 -0.907 . . . . 0.0 110.305 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.522 ' N ' ' CD1' ' A' ' 72' ' ' ILE . 1.2 mp -94.06 119.39 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.243 -0.911 . . . . 0.0 110.041 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.56 139.75 30.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.32 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.4 p -90.71 170.54 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.245 -0.909 . . . . 0.0 110.46 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.586 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.2 OUTLIER -143.85 158.84 43.42 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.345 -0.847 . . . . 0.0 110.988 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.445 ' O ' ' OG ' ' B' ' 80' ' ' SER . 69.7 p -133.37 134.19 43.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.39 -0.819 . . . . 0.0 109.854 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -167.75 -168.22 29.56 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -147.78 149.15 31.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.232 -1.158 . . . . 0.0 110.334 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.424 ' HE3' HG23 ' A' ' 81' ' ' ILE . 24.5 mmm -124.75 154.48 40.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 110.092 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.471 ' O ' HG21 ' A' ' 81' ' ' ILE . 0.7 OUTLIER -130.23 103.86 6.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -0.963 . . . . 0.0 110.394 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.471 HG21 ' O ' ' A' ' 80' ' ' SER . 13.2 pt . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.194 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.6 mmm . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.173 0.511 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' THR . . . . . 0.432 ' O ' ' CG2' ' B' ' 2' ' ' THR . 14.7 t -88.65 125.42 63.14 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.269 -0.894 . . . . 0.0 110.48 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.558 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.1 Cg_endo -63.35 152.27 80.78 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.051 1.553 . . . . 0.0 110.408 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.432 HG22 ' C ' ' B' ' 3' ' ' PRO . 10.3 pt -144.12 164.39 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.232 -0.918 . . . . 0.0 110.397 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.447 ' O ' HG22 ' B' ' 50' ' ' THR . 41.5 t -146.32 137.27 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.269 -0.895 . . . . 0.0 110.437 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.602 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.3 OUTLIER -105.4 131.0 53.37 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.349 -0.844 . . . . 0.0 109.582 179.585 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.481 ' O ' HG22 ' B' ' 48' ' ' ILE . 0.4 OUTLIER -122.22 139.85 53.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.065 -1.022 . . . . 0.0 110.703 -179.408 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.483 ' CG ' ' N ' ' B' ' 9' ' ' GLY . 80.5 tttt -142.35 170.43 15.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 110.176 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.483 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 153.81 -160.5 29.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . 0.461 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 45.8 t0 -64.94 130.98 45.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -1.139 . . . . 0.0 110.372 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.33 -30.93 13.18 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.311 -0.868 . . . . 0.0 110.388 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -83.92 -48.25 10.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.264 -0.898 . . . . 0.0 110.508 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.438 ' HB ' ' HB3' ' B' ' 10' ' ' ASP . 99.2 m -57.78 -14.57 6.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.462 ' HA ' HD11 ' B' ' 17' ' ' LEU . 70.4 mt -83.04 -32.22 26.99 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.313 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -59.53 -35.91 75.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.156 -0.965 . . . . 0.0 110.065 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.428 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.7 t -70.46 -34.82 72.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.198 -0.939 . . . . 0.0 110.108 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' B' ' 14' ' ' LEU . 13.6 mt -58.84 -50.77 72.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 0.0 110.164 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.576 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 33.1 ttt180 -46.29 -30.19 1.95 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.293 -0.88 . . . . 0.0 109.903 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.478 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 30.0 t80 -65.06 -47.3 77.8 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.405 -0.809 . . . . 0.0 110.319 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.71 -33.9 72.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.209 -0.932 . . . . 0.0 110.27 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.576 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.4 m-30 -66.72 -22.87 66.05 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.0 110.293 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.7 mmtt -63.37 -30.02 71.22 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.95 . . . . 0.0 110.412 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -74.92 -48.04 26.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.195 -0.941 . . . . 0.0 110.052 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.486 ' HB3' ' HB2' ' B' ' 27' ' ' LEU . 15.8 m-70 -94.82 41.63 1.09 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.269 -0.894 . . . . 0.0 110.063 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.536 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 25.2 p -57.04 -18.87 15.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.336 -0.853 . . . . 0.0 110.14 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 86.8 m -97.27 6.11 48.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.858 . . . . 0.0 110.199 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.486 ' HB2' ' HB3' ' B' ' 24' ' ' HIS . 0.7 OUTLIER -92.26 -6.2 50.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.224 -0.922 . . . . 0.0 110.324 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.536 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 7.6 p90 -143.29 -177.1 5.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.372 -0.83 . . . . 0.0 109.836 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.3 m -94.8 -63.23 1.2 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.244 -0.91 . . . . 0.0 109.214 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -156.8 143.09 18.17 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 120.985 -1.072 . . . . 0.0 108.625 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.472 HG11 ' O ' ' B' ' 31' ' ' VAL . 7.5 p -89.95 110.77 22.29 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 110.268 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.579 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -52.7 145.84 11.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.4 -0.812 . . . . 0.0 110.195 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' SER . . . . . 0.546 ' HB2' ' CG2' ' A' ' 38' ' ' THR . 6.8 t -60.66 160.86 8.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.284 -0.885 . . . . 0.0 110.102 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -67.99 122.73 18.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -0.901 . . . . 0.0 110.38 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.585 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 26.1 p-90 -147.76 167.02 25.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.618 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.481 ' CD2' HG13 ' B' ' 48' ' ' ILE . 12.3 t-80 -162.61 -173.66 3.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.019 -1.051 . . . . 0.0 110.815 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.523 ' CH2' HG23 ' A' ' 52' ' ' THR . 19.9 m95 -79.43 100.79 7.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.535 -0.728 . . . . 0.0 110.379 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' THR . . . . . 0.557 ' CG2' ' HB2' ' A' ' 33' ' ' SER . 1.4 t . . . . . 0 N--CA 1.494 1.738 0 O-C-N 121.388 -0.82 . . . . 0.0 110.241 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.179 0.514 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.481 HG13 ' CD2' ' B' ' 36' ' ' HIS . 2.5 mt -140.49 155.75 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 110.338 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 62.1 t -138.57 117.89 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.591 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 93.9 m -93.77 158.49 15.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.208 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.33 134.42 37.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.973 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.583 HG23 ' CH2' ' A' ' 37' ' ' TRP . 0.8 OUTLIER -96.5 124.63 40.55 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.223 -0.923 . . . . 0.0 110.47 -179.819 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.558 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -104.09 146.79 28.22 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.335 -0.853 . . . . 0.0 109.887 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -79.17 -8.23 58.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.16 -0.963 . . . . 0.0 110.487 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 84.3 p -170.71 135.01 1.09 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.203 -0.935 . . . . 0.0 110.252 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.504 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 42.9 mt-10 -51.17 -37.43 46.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.965 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . 0.481 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 35.3 t-105 -53.82 -58.57 6.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.124 -0.985 . . . . 0.0 109.81 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -58.78 -28.54 66.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.173 -0.954 . . . . 0.0 110.327 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.504 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 54.0 ttp180 -59.47 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.143 -0.973 . . . . 0.0 110.853 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.516 ' OD1' ' N ' ' B' ' 61' ' ' GLN . 1.1 p30 -61.04 -33.76 73.79 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.056 -1.027 . . . . 0.0 110.785 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.516 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 56.7 mt-30 -65.78 -47.26 75.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.062 -1.024 . . . . 0.0 110.122 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.497 ' CD1' ' OH ' ' B' ' 53' ' ' TYR . 37.2 t80 -55.88 -65.49 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 110.646 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . 0.471 HD21 ' HA ' ' B' ' 60' ' ' ASP . 2.9 pp -59.13 -18.85 39.47 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.352 -0.842 . . . . 0.0 110.426 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 3.3 t -81.54 -20.32 40.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.127 -0.983 . . . . 0.0 110.171 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.68 -73.5 0.59 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.105 -0.997 . . . . 0.0 110.244 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 34.0 m -47.54 130.17 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.212 -0.93 . . . . 0.0 109.937 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.53 108.7 6.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.173 -0.954 . . . . 0.0 110.426 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 25.1 mt -89.47 121.89 68.86 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.011 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -57.0 178.55 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 123.968 1.509 . . . . 0.0 110.557 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -91.75 -12.34 34.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.206 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.1 m -84.76 -16.79 40.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.212 -0.93 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.52 ' N ' ' CD1' ' B' ' 72' ' ' ILE . 1.2 mp -93.96 119.14 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.147 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.43 139.69 30.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.328 -0.857 . . . . 0.0 110.175 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 8.4 p -90.6 170.69 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 110.518 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' SER . . . . . 0.602 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.87 158.53 43.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.432 -0.792 . . . . 0.0 111.008 179.823 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 82.8 p -133.34 134.21 43.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.453 -0.779 . . . . 0.0 109.97 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -168.21 -167.84 29.45 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -147.81 149.45 32.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.1 -1.235 . . . . 0.0 110.507 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.438 ' HE3' ' CG2' ' B' ' 81' ' ' ILE . 24.1 mmm -125.09 153.18 43.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.169 -0.957 . . . . 0.0 110.017 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.469 ' O ' HG21 ' B' ' 81' ' ' ILE . 0.7 OUTLIER -128.89 104.41 7.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.211 -0.931 . . . . 0.0 110.24 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.469 HG21 ' O ' ' B' ' 80' ' ' SER . 13.7 pt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.181 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 mtm . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.171 0.51 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.72 118.09 66.85 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.175 -0.953 . . . . 0.0 110.15 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.511 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 50.6 Cg_endo -53.54 147.0 40.37 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.093 1.575 . . . . 0.0 110.411 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 3' ' ' PRO . 1.1 pt -143.06 109.93 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.34 -0.85 . . . . 0.0 110.024 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.414 HG11 HD11 ' A' ' 7' ' ' LEU . 48.9 t -93.95 153.92 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 110.424 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.566 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 0.0 OUTLIER -134.71 117.14 15.7 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.372 -0.83 . . . . 0.0 109.821 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.414 HD11 HG11 ' A' ' 5' ' ' VAL . 0.8 OUTLIER -112.74 145.36 40.68 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 -179.716 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 20.4 tttm -143.42 169.8 16.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.265 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.79 -157.35 27.24 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.472 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 81.9 m-20 -64.79 123.5 19.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.179 -1.189 . . . . 0.0 109.948 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -49.77 -43.94 48.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.842 . . . . 0.0 110.632 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.42 -48.22 82.68 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.241 -0.912 . . . . 0.0 110.451 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.4 m -57.96 -28.19 64.12 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.301 -0.874 . . . . 0.0 110.419 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 10' ' ' ASP . 97.5 mt -65.69 -30.03 70.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.214 -0.929 . . . . 0.0 110.042 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.1 -36.92 78.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.32 -0.862 . . . . 0.0 110.147 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 4.6 t -70.06 -40.56 75.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 110.762 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.492 HD12 ' CD1' ' A' ' 72' ' ' ILE . 1.0 OUTLIER -58.75 -52.03 67.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.973 -1.079 . . . . 0.0 110.188 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 7.3 ttt-85 -48.31 -27.6 2.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.886 . . . . 0.0 110.258 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.526 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 64.6 t80 -64.65 -25.74 68.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.224 -0.922 . . . . 0.0 110.074 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -83.55 -25.33 31.07 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.228 -0.92 . . . . 0.0 109.919 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.565 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 9.2 m-30 -66.5 -22.62 66.18 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.387 -0.821 . . . . 0.0 110.439 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -63.32 -47.35 82.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.06 -20.26 59.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.189 -0.944 . . . . 0.0 109.839 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.456 ' HB3' ' CD1' ' A' ' 27' ' ' LEU . 20.8 m170 -95.42 39.67 1.12 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 110.161 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.493 ' SG ' ' N ' ' A' ' 26' ' ' THR . 19.3 p -57.06 -36.2 70.24 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.11 -0.994 . . . . 0.0 110.368 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.493 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 8.7 t -97.27 67.04 2.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.134 -0.979 . . . . 0.0 110.543 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.528 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 10.0 mt -148.11 -43.95 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.258 -0.901 . . . . 0.0 110.074 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -107.11 170.25 8.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.208 -0.932 . . . . 0.0 109.725 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.34 -33.84 10.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.087 -1.008 . . . . 0.0 111.046 -179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.417 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -159.73 116.82 2.6 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.097 . . . . 0.0 110.924 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.419 HG11 ' O ' ' A' ' 31' ' ' VAL . 6.4 p -90.03 131.33 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 110.019 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.551 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 53.8 p -86.02 149.23 25.31 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.251 -0.905 . . . . 0.0 110.302 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.0 t -61.36 161.58 9.01 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.142 -0.974 . . . . 0.0 110.013 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.87 128.37 36.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.326 -0.859 . . . . 0.0 110.406 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.55 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 36.6 p-90 -146.36 -179.25 6.62 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.294 -0.879 . . . . 0.0 109.77 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.565 ' CE1' ' O ' ' A' ' 37' ' ' TRP . 7.5 t-80 -162.56 169.71 19.79 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.1 -1.0 . . . . 0.0 110.208 -179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.565 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 56.4 m95 -79.07 110.01 13.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.212 -0.93 . . . . 0.0 110.159 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.274 -0.891 . . . . 0.0 110.183 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.448 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.72 0 CA-C-O 121.293 0.568 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.432 HG12 ' HG3' ' A' ' 8' ' ' LYS . 10.0 mt -142.48 157.71 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.226 -0.921 . . . . 0.0 109.915 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -139.0 179.51 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.154 -0.966 . . . . 0.0 110.521 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.566 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 49.2 m -145.65 153.77 41.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.391 -0.818 . . . . 0.0 109.571 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.507 ' N ' HG21 ' A' ' 50' ' ' THR . 0.3 OUTLIER -133.91 128.79 35.28 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.034 -1.042 . . . . 0.0 110.342 -179.688 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -96.98 127.13 42.64 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.368 -0.833 . . . . 0.0 110.168 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.522 ' OH ' ' CD2' ' A' ' 62' ' ' PHE . 53.8 m-85 -106.85 147.79 29.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.31 -0.869 . . . . 0.0 110.064 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.44 -6.02 37.2 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.847 . . . . 0.0 110.773 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 p -175.84 174.51 2.15 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -1.0 . . . . 0.0 110.594 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.98 -44.98 45.18 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.317 -0.865 . . . . 0.0 110.353 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.505 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 67.0 t-105 -53.62 -50.09 66.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.175 -0.953 . . . . 0.0 109.916 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 53.9 tt0 -57.08 -39.56 75.21 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 110.586 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.521 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 6.4 ttp180 -59.26 -40.67 86.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.98 -1.075 . . . . 0.0 110.643 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.505 ' OD2' ' O ' ' A' ' 57' ' ' TRP . 0.0 OUTLIER -61.45 -39.61 91.48 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.096 -1.003 . . . . 0.0 110.749 -179.429 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.462 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 23.1 mt-30 -65.4 -44.12 88.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.226 -0.921 . . . . 0.0 110.481 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.522 ' CD2' ' OH ' ' A' ' 53' ' ' TYR . 86.2 t80 -55.3 -42.01 73.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.179 -0.951 . . . . 0.0 110.119 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.5 mt -59.61 -13.24 8.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.7 p -98.83 -14.87 19.47 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.194 -0.941 . . . . 0.0 110.423 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 4.5 mm-40 -96.48 -12.65 23.87 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.173 -0.954 . . . . 0.0 109.992 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 13.8 m -133.22 105.21 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.302 -0.874 . . . . 0.0 110.084 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -62.37 123.66 18.84 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 110.398 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.405 HG23 HD13 ' A' ' 68' ' ' ILE . 25.3 mm -88.95 113.45 56.1 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.293 -0.88 . . . . 0.0 110.266 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.441 ' HG2' ' CG1' ' A' ' 72' ' ' ILE . 44.3 Cg_endo -56.61 152.33 41.72 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.042 1.548 . . . . 0.0 110.499 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -68.75 -11.85 60.79 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.275 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.2 m -84.64 -24.89 28.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.198 -0.939 . . . . 0.0 109.974 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.492 ' CD1' HD12 ' A' ' 17' ' ' LEU . 12.3 mt -94.12 123.45 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.466 -0.771 . . . . 0.0 110.148 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -94.48 138.0 32.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.23 -0.919 . . . . 0.0 110.023 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -91.26 172.59 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.204 -0.935 . . . . 0.0 110.574 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.525 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.89 155.41 44.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.566 -0.708 . . . . 0.0 110.381 179.524 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.486 ' O ' ' HB3' ' B' ' 80' ' ' SER . 0.6 OUTLIER -133.19 136.13 45.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 110.186 179.26 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -176.39 -172.33 40.98 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.417 ' CA ' HG12 ' A' ' 4' ' ' ILE . 97.7 m-85 -148.14 155.18 41.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.09 -1.241 . . . . 0.0 110.64 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' B' ' 79' ' ' MET . 27.2 mtt -123.64 174.79 7.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.333 -0.855 . . . . 0.0 110.168 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.488 ' C ' ' CG1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -139.08 109.19 6.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 110.085 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.488 ' CG1' ' C ' ' A' ' 80' ' ' SER . 10.8 mt . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.173 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.1 mtm . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.276 0.56 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.07 118.07 67.19 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.319 -0.863 . . . . 0.0 110.078 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.505 ' O ' HG22 ' B' ' 4' ' ' ILE . 49.8 Cg_endo -53.9 147.61 41.42 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.942 1.496 . . . . 0.0 110.496 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.505 HG22 ' O ' ' B' ' 3' ' ' PRO . 1.1 pt -142.95 109.52 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.984 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -93.8 153.13 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.306 -0.871 . . . . 0.0 110.271 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.522 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 0.0 OUTLIER -134.13 117.17 16.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.332 -0.855 . . . . 0.0 109.952 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.467 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.8 OUTLIER -112.87 145.5 40.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.178 -0.951 . . . . 0.0 110.33 -179.785 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.465 ' HG3' HG12 ' B' ' 48' ' ' ILE . 19.9 tttm -143.46 169.76 17.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.294 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.71 -157.38 27.26 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . 0.477 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 81.8 m-20 -64.57 123.1 18.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.18 -1.188 . . . . 0.0 110.041 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.402 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.9 -43.24 49.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.297 -0.877 . . . . 0.0 110.571 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -60.48 -48.33 82.22 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.194 -0.941 . . . . 0.0 110.358 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.9 m -58.31 -28.42 65.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.452 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 10' ' ' ASP . 94.3 mt -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.905 . . . . 0.0 110.145 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -60.12 -36.96 78.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.3 -0.875 . . . . 0.0 110.19 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.526 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 4.7 t -70.0 -40.55 75.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 110.64 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.496 HD12 ' CD1' ' B' ' 72' ' ' ILE . 1.0 OUTLIER -58.83 -51.81 68.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.014 -1.054 . . . . 0.0 110.252 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.51 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 7.3 ttt-85 -48.29 -27.4 2.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.37 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.526 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 65.4 t80 -64.6 -26.33 68.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.277 -0.889 . . . . 0.0 110.15 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -82.89 -25.27 32.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.915 . . . . 0.0 109.943 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.575 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.3 m-30 -66.46 -23.04 66.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.359 -0.838 . . . . 0.0 110.425 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -63.21 -47.01 84.35 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.25 -0.906 . . . . 0.0 110.304 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.11 -20.71 59.31 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.179 -0.951 . . . . 0.0 109.859 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.453 ' HB3' ' CD1' ' B' ' 27' ' ' LEU . 20.7 m170 -95.11 40.01 1.11 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.462 -0.773 . . . . 0.0 110.072 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' B' ' 26' ' ' THR . 18.5 p -57.3 -36.49 71.13 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.91 . . . . 0.0 110.354 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.496 ' N ' ' SG ' ' B' ' 25' ' ' CYS . 7.0 t -97.21 67.05 2.13 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.149 -0.969 . . . . 0.0 110.582 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.538 ' O ' ' NE2' ' B' ' 58' ' ' GLN . 10.1 mt -148.16 -44.38 0.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.204 -0.935 . . . . 0.0 110.049 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -106.49 170.31 8.0 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.204 -0.935 . . . . 0.0 109.763 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.26 -33.95 10.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.021 -1.05 . . . . 0.0 111.005 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . 0.401 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -159.67 116.91 2.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.991 -1.068 . . . . 0.0 110.866 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.453 HG11 ' O ' ' B' ' 31' ' ' VAL . 6.9 p -90.11 130.1 39.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.262 -0.899 . . . . 0.0 109.935 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.55 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 57.6 p -84.58 149.37 25.92 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.223 -0.923 . . . . 0.0 110.295 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -61.45 162.22 8.34 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.088 -1.008 . . . . 0.0 110.219 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.98 127.85 34.36 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.896 . . . . 0.0 110.269 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.551 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 37.9 p-90 -146.14 -178.92 6.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.22 -0.925 . . . . 0.0 109.882 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.576 ' CE1' ' O ' ' B' ' 37' ' ' TRP . 7.9 t-80 -162.56 169.38 20.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.054 -1.029 . . . . 0.0 110.414 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.576 ' O ' ' CE1' ' B' ' 36' ' ' HIS . 58.1 m95 -79.07 110.15 14.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 109.903 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.225 -179.818 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.439 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.169 0.509 . . . . 0.0 110.621 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.467 HG23 ' O ' ' B' ' 7' ' ' LEU . 9.2 mt -142.65 157.95 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.345 -0.847 . . . . 0.0 109.963 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -139.14 179.95 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.123 -0.985 . . . . 0.0 110.637 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.522 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 54.5 m -145.9 153.07 40.44 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 109.811 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.494 ' N ' HG21 ' B' ' 50' ' ' THR . 0.3 OUTLIER -133.3 128.84 36.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.166 -0.959 . . . . 0.0 110.464 -179.76 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 4.7 m -97.12 126.92 42.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.371 -0.83 . . . . 0.0 110.246 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.506 ' CD2' ' HA ' ' B' ' 59' ' ' ARG . 56.6 m-85 -106.87 148.17 28.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.258 -0.901 . . . . 0.0 110.013 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.15 -6.41 42.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.805 -179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 p -174.81 174.89 2.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.064 -1.023 . . . . 0.0 110.264 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -75.91 -44.14 41.75 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 67.0 t-105 -53.64 -49.95 66.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.881 . . . . 0.0 110.197 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.0 tt0 -57.3 -39.39 75.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.22 -0.925 . . . . 0.0 110.645 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.506 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 6.3 ttp180 -59.29 -41.35 88.75 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.138 -0.976 . . . . 0.0 110.714 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.485 ' OD2' ' O ' ' B' ' 57' ' ' TRP . 0.0 OUTLIER -61.19 -39.18 89.22 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.124 -0.985 . . . . 0.0 110.741 -179.386 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.452 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 23.3 mt-30 -65.42 -44.24 87.97 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.089 -1.007 . . . . 0.0 110.437 -179.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.463 ' CD2' ' OH ' ' B' ' 53' ' ' TYR . 83.7 t80 -55.28 -41.8 72.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.137 -0.977 . . . . 0.0 109.935 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.0 mt -59.68 -12.56 7.18 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.246 -0.909 . . . . 0.0 110.176 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 12.3 p -99.5 -14.79 18.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.228 -0.92 . . . . 0.0 110.488 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . 0.468 ' HA ' ' OE1' ' B' ' 65' ' ' GLN . 4.5 mm-40 -96.45 -12.68 23.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 110.113 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 13.1 m -133.26 104.65 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.351 -0.843 . . . . 0.0 110.171 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.6 tptp -62.0 123.86 19.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.428 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.401 HG23 HD13 ' B' ' 68' ' ' ILE . 25.3 mm -88.95 113.42 55.98 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.288 -0.883 . . . . 0.0 110.298 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.452 ' HG2' HG13 ' B' ' 72' ' ' ILE . 45.0 Cg_endo -56.4 152.6 38.73 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.957 1.504 . . . . 0.0 110.423 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -69.29 -11.86 61.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.219 -0.926 . . . . 0.0 110.29 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 10.7 m -84.48 -24.63 29.35 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.252 -0.905 . . . . 0.0 109.882 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.496 ' CD1' HD12 ' B' ' 17' ' ' LEU . 12.2 mt -94.37 123.41 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.275 -0.89 . . . . 0.0 110.267 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 99.1 m -94.53 138.07 32.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.163 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.7 t -91.32 172.49 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' SER . . . . . 0.506 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -143.09 155.65 44.65 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.517 -0.74 . . . . 0.0 110.346 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' THR . . . . . 0.464 ' O ' ' HB3' ' A' ' 80' ' ' SER . 0.6 OUTLIER -133.41 135.63 44.74 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.18 -0.95 . . . . 0.0 110.203 179.361 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.35 -172.21 40.03 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.417 ' CA ' HG12 ' B' ' 4' ' ' ILE . 97.7 m-85 -147.98 155.12 41.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.109 -1.23 . . . . 0.0 110.524 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' A' ' 79' ' ' MET . 27.4 mtt -123.98 173.75 8.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.405 -0.809 . . . . 0.0 110.052 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.487 ' C ' ' CG1' ' B' ' 81' ' ' ILE . 0.0 OUTLIER -138.23 109.14 6.71 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.19 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.487 ' CG1' ' C ' ' B' ' 80' ' ' SER . 10.4 mt . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.108 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' A' ' 2' ' ' THR . 70.1 mtm . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.213 0.53 . . . . 0.0 110.176 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' A' ' 1' ' ' MET . 76.7 m -43.71 105.23 0.42 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.498 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 46.5 Cg_endo -56.42 157.65 17.77 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 O-C-N 124.15 1.605 . . . . 0.0 110.743 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.5 pp -144.09 168.28 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.37 -0.832 . . . . 0.0 109.947 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.435 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 8.8 p -146.11 129.82 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.949 . . . . 0.0 110.544 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.547 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 2.7 m170 -106.35 122.94 47.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.203 -0.936 . . . . 0.0 110.072 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.8 mt -114.36 146.87 40.01 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.179 -0.951 . . . . 0.0 110.127 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.508 ' HB2' HG12 ' A' ' 48' ' ' ILE . 31.9 ttpt -141.43 165.58 27.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.186 -0.946 . . . . 0.0 110.721 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.42 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 154.28 -168.11 32.5 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.445 ' O ' ' HB ' ' A' ' 13' ' ' THR . 9.3 m-20 -64.71 142.27 58.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.183 -1.187 . . . . 0.0 109.921 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.428 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -49.89 -68.5 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.222 -0.924 . . . . 0.0 110.282 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -44.27 -43.56 7.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.3 -0.875 . . . . 0.0 110.245 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.445 ' HB ' ' O ' ' A' ' 10' ' ' ASP . 7.0 m -58.11 -28.52 64.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.161 -0.962 . . . . 0.0 110.309 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 17.6 mt -77.17 -29.8 54.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.272 -0.892 . . . . 0.0 110.164 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.41 ' HB2' ' HE3' ' A' ' 15' ' ' LYS . 13.5 ttmt -60.01 -34.59 73.56 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.288 -0.882 . . . . 0.0 110.054 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 12.3 t -70.13 -37.08 75.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.355 -0.841 . . . . 0.0 110.664 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.7 mt -58.98 -48.17 82.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.137 -0.977 . . . . 0.0 110.45 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.3 ttp180 -47.33 -33.46 5.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.397 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 19' ' ' TYR . 4.2 t80 -64.59 -38.44 91.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.29 -0.882 . . . . 0.0 110.305 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -69.46 -33.16 72.51 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.18 -0.95 . . . . 0.0 110.213 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.536 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.48 -31.74 72.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.191 -0.943 . . . . 0.0 110.276 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.46 -16.54 60.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.227 -0.921 . . . . 0.0 110.148 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -75.02 -41.0 60.18 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.651 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.576 ' CB ' ' HB2' ' A' ' 27' ' ' LEU . 5.0 m-70 -95.08 75.97 3.49 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.305 -0.872 . . . . 0.0 109.559 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 p -58.18 -6.45 0.63 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.484 -0.76 . . . . 0.0 111.933 -179.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.82 31.98 1.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.584 -1.322 . . . . 0.0 111.1 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.576 ' HB2' ' CB ' ' A' ' 24' ' ' HIS . 2.1 mt -93.1 -35.46 13.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.437 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -107.94 169.68 8.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.17 -0.957 . . . . 0.0 110.318 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.517 ' OG1' ' N ' ' A' ' 54' ' ' ASP . 36.3 m -100.2 -34.36 10.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.286 -0.884 . . . . 0.0 111.131 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.447 ' HB3' ' CZ3' ' B' ' 37' ' ' TRP . . . -159.75 117.72 2.7 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.977 -1.077 . . . . 0.0 110.72 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.441 HG11 ' O ' ' A' ' 31' ' ' VAL . 4.9 p -90.69 105.64 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.127 -0.983 . . . . 0.0 109.9 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.45 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 1.4 p -68.58 155.06 40.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.142 -0.974 . . . . 0.0 110.404 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.6 p -61.37 163.83 6.22 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 109.992 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -67.99 125.58 26.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.222 -0.924 . . . . 0.0 110.471 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.527 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 25.9 p-90 -146.11 173.34 12.28 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.079 -1.013 . . . . 0.0 109.738 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.527 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 11.0 p80 -162.61 -175.38 4.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.084 -1.01 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.459 ' CZ3' ' HB3' ' B' ' 30' ' ' ALA . 68.3 m95 -79.31 155.03 28.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.278 -0.889 . . . . 0.0 110.105 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.459 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.243 0.544 . . . . 0.0 109.78 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.508 HG12 ' HB2' ' A' ' 8' ' ' LYS . 43.6 mt -142.69 141.9 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.118 -0.989 . . . . 0.0 110.601 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.4 ' N ' HG21 ' A' ' 48' ' ' ILE . 4.4 t -111.63 117.32 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.414 -0.804 . . . . 0.0 109.958 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.476 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 50.3 m -93.69 146.58 23.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 110.008 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.495 ' N ' HD12 ' A' ' 51' ' ' LEU . 5.4 mp -135.62 129.73 33.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.128 -0.983 . . . . 0.0 110.273 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.95 136.4 38.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.548 -0.72 . . . . 0.0 110.114 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.498 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 89.9 m-85 -110.42 150.6 28.59 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.85 . . . . 0.0 109.865 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.517 ' N ' ' OG1' ' A' ' 29' ' ' THR . 1.8 t0 -84.52 -10.06 57.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.976 . . . . 0.0 110.458 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.492 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 0.4 OUTLIER -149.06 150.83 33.43 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.118 -0.989 . . . . 0.0 110.314 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.96 -56.21 9.86 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.523 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 12.3 p90 -53.95 -36.81 63.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.195 -0.941 . . . . 0.0 110.003 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.523 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 64.7 tt0 -58.32 -49.22 77.97 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.262 -0.899 . . . . 0.0 110.22 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -58.71 -36.27 73.99 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.264 -0.897 . . . . 0.0 110.112 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.487 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 18.8 m-20 -61.42 -42.24 98.43 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.28 -0.888 . . . . 0.0 110.528 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.497 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 62.1 mt-30 -65.92 -37.32 85.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.06 -1.025 . . . . 0.0 110.308 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.547 ' CD1' ' N ' ' A' ' 63' ' ' LEU . 10.5 t80 -55.41 -63.75 1.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.204 -0.935 . . . . 0.0 110.276 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.547 ' N ' ' CD1' ' A' ' 62' ' ' PHE . 3.2 pp -59.79 -17.1 33.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.251 -0.906 . . . . 0.0 110.585 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.442 ' HB3' ' O ' ' A' ' 60' ' ' ASP . 0.9 OUTLIER -83.87 -20.81 32.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.948 . . . . 0.0 110.434 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 41.5 mt-30 -95.53 -61.92 1.38 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.166 -0.959 . . . . 0.0 110.17 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 15.7 m -79.63 70.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.156 -0.965 . . . . 0.0 109.876 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -44.85 117.98 1.49 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.551 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.469 HG12 ' HB ' ' A' ' 72' ' ' ILE . 0.9 OUTLIER -88.61 134.31 34.34 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 110.141 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.424 ' HG2' HD13 ' A' ' 72' ' ' ILE . 47.0 Cg_endo -55.25 176.52 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 123.875 1.46 . . . . 0.0 110.66 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.3 tptt -81.94 3.24 27.14 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.29 -33.19 24.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 109.795 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.469 ' HB ' HG12 ' A' ' 68' ' ' ILE . 2.0 mp -93.92 123.21 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.412 -0.805 . . . . 0.0 109.903 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.6 m -94.61 138.17 32.81 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -90.86 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 0.0 111.171 -178.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.547 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -143.69 157.57 44.3 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.736 -0.603 . . . . 0.0 110.058 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.9 p -133.13 133.12 42.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.187 -0.946 . . . . 0.0 110.172 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.7 -165.69 15.76 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' B' ' 78' ' ' PHE . 55.9 m-85 -147.88 153.63 39.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.185 -1.185 . . . . 0.0 110.356 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 93.5 mmm -139.26 152.78 47.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.219 -0.926 . . . . 0.0 110.2 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.5 t -134.96 100.57 4.62 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.229 -0.919 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 24.9 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.254 179.796 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' B' ' 2' ' ' THR . 69.6 mtm . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.236 0.541 . . . . 0.0 110.106 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' B' ' 1' ' ' MET . 54.7 m -43.79 104.25 0.37 Allowed Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.324 -0.86 . . . . 0.0 110.169 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.505 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.1 Cg_endo -55.38 157.73 14.04 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.14 1.6 . . . . 0.0 110.746 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 2.6 pp -144.23 168.55 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.297 -0.877 . . . . 0.0 110.068 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.434 ' O ' ' CG1' ' B' ' 5' ' ' VAL . 9.4 p -146.45 129.76 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.154 -0.966 . . . . 0.0 110.552 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.554 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 2.9 m170 -106.52 123.34 47.95 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.268 -0.895 . . . . 0.0 110.152 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 12.1 mt -114.47 146.61 40.45 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.112 -0.992 . . . . 0.0 110.163 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.506 ' HB2' HG12 ' B' ' 48' ' ' ILE . 31.7 ttpt -141.48 165.42 27.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.08 -1.013 . . . . 0.0 110.723 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.425 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 154.44 -167.96 32.56 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . 0.429 ' O ' ' HB ' ' B' ' 13' ' ' THR . 8.8 m-20 -64.77 142.84 58.29 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.272 -1.134 . . . . 0.0 109.99 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -49.89 -68.72 0.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.231 -0.918 . . . . 0.0 110.529 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -44.43 -43.61 7.86 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 110.358 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.429 ' HB ' ' O ' ' B' ' 10' ' ' ASP . 6.3 m -57.83 -28.74 64.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.164 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 19.9 mt -76.53 -30.31 57.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' B' ' 15' ' ' LYS . 12.5 ttmt -59.96 -35.11 74.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -0.855 . . . . 0.0 110.156 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.481 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 12.0 t -69.87 -36.75 75.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.202 -0.937 . . . . 0.0 110.425 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 19.0 mt -58.81 -48.62 80.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.092 -1.005 . . . . 0.0 110.541 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 19.0 ttp180 -47.5 -32.78 5.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.17 -0.956 . . . . 0.0 110.349 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.536 ' C ' ' CD1' ' B' ' 19' ' ' TYR . 4.6 t80 -64.76 -38.12 89.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.178 -0.951 . . . . 0.0 110.329 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -69.91 -33.4 72.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.201 -0.937 . . . . 0.0 110.264 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.54 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.34 -31.42 72.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.263 -0.898 . . . . 0.0 110.375 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.39 -16.83 61.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.204 -0.935 . . . . 0.0 110.254 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -74.89 -41.17 60.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.193 -0.942 . . . . 0.0 109.75 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.575 ' CB ' ' HB2' ' B' ' 27' ' ' LEU . 5.1 m-70 -94.89 76.11 3.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.263 -0.898 . . . . 0.0 109.368 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.03 -6.84 0.65 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.441 -0.787 . . . . 0.0 112.088 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.67 31.88 1.65 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.589 -1.319 . . . . 0.0 111.099 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.575 ' HB2' ' CB ' ' B' ' 24' ' ' HIS . 2.0 mt -93.02 -34.95 13.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.057 -1.027 . . . . 0.0 110.355 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -108.04 169.96 8.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.524 ' OG1' ' N ' ' B' ' 54' ' ' ASP . 40.1 m -100.32 -34.82 9.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.28 -0.888 . . . . 0.0 111.077 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . 0.459 ' HB3' ' CZ3' ' A' ' 37' ' ' TRP . . . -159.83 118.21 2.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.965 -1.085 . . . . 0.0 110.643 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.438 HG11 ' O ' ' B' ' 31' ' ' VAL . 5.4 p -90.82 105.17 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.116 -0.99 . . . . 0.0 110.055 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.471 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 1.7 p -68.22 154.76 41.08 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.146 -0.972 . . . . 0.0 110.292 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 12.9 p -61.36 164.64 5.36 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.173 -0.954 . . . . 0.0 110.153 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.13 124.93 24.79 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.292 -0.88 . . . . 0.0 110.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.54 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 25.1 p-90 -145.57 173.5 11.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.026 -1.046 . . . . 0.0 109.789 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.54 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 10.4 p80 -162.69 -175.06 4.24 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.614 -179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.447 ' CZ3' ' HB3' ' A' ' 30' ' ' ALA . 67.1 m95 -79.8 155.66 27.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.333 -0.854 . . . . 0.0 110.063 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 O-C-N 121.13 -0.981 . . . . 0.0 110.23 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.475 ' HA ' ' HB3' ' B' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.112 0.482 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.506 HG12 ' HB2' ' B' ' 8' ' ' LYS . 45.1 mt -142.66 142.34 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.169 -0.957 . . . . 0.0 110.645 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . 0.41 ' N ' HG21 ' B' ' 48' ' ' ILE . 4.4 t -112.01 117.06 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.443 -0.786 . . . . 0.0 109.716 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.448 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 54.5 m -93.15 147.4 22.91 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.251 -0.906 . . . . 0.0 109.916 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.466 HD12 ' N ' ' B' ' 51' ' ' LEU . 5.3 mp -136.28 129.77 31.98 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 110.317 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.14 136.24 38.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.505 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 89.1 m-85 -110.56 150.74 28.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.294 -0.879 . . . . 0.0 109.839 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.524 ' N ' ' OG1' ' B' ' 29' ' ' THR . 1.4 t0 -84.7 -10.16 57.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.133 -0.979 . . . . 0.0 110.516 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' SER . . . . . 0.517 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 0.4 OUTLIER -148.49 151.51 35.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.153 -0.967 . . . . 0.0 110.243 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.31 -56.03 10.0 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.279 -0.888 . . . . 0.0 109.978 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . 0.53 ' CD1' ' N ' ' B' ' 58' ' ' GLN . 12.3 p90 -54.21 -37.15 64.25 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 0.0 110.228 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.53 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 63.8 tt0 -58.37 -48.32 80.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -0.929 . . . . 0.0 110.206 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -59.14 -36.59 75.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.149 -0.969 . . . . 0.0 110.154 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.489 ' O ' ' HG ' ' B' ' 63' ' ' LEU . 19.3 m-20 -61.31 -41.91 97.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 110.437 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.485 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 61.6 mt-30 -65.91 -37.32 85.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 0.0 110.145 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.546 ' CD1' ' N ' ' B' ' 63' ' ' LEU . 10.5 t80 -55.64 -63.57 1.13 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.116 -0.99 . . . . 0.0 110.262 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . 0.546 ' N ' ' CD1' ' B' ' 62' ' ' PHE . 3.3 pp -59.93 -16.65 31.48 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.272 -0.892 . . . . 0.0 110.516 -179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' B' ' 60' ' ' ASP . 1.0 OUTLIER -84.5 -21.09 30.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.244 -0.91 . . . . 0.0 110.376 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 39.3 mt-30 -95.22 -62.85 1.23 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.982 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 16.3 m -78.57 70.88 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.049 -1.032 . . . . 0.0 109.816 179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -45.75 118.37 1.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.289 -0.882 . . . . 0.0 110.472 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.451 HG12 ' HB ' ' B' ' 72' ' ' ILE . 0.9 OUTLIER -88.71 134.91 32.94 Favored Pre-proline 0 N--CA 1.486 1.35 0 O-C-N 121.232 -0.917 . . . . 0.0 110.331 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.459 ' HG2' HD13 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -55.88 176.8 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.048 1.552 . . . . 0.0 110.663 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -82.61 3.23 29.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.351 -0.843 . . . . 0.0 110.356 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -32.79 24.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.131 -0.981 . . . . 0.0 109.696 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.459 HD13 ' HG2' ' B' ' 69' ' ' PRO . 2.0 mp -94.48 123.61 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.552 -0.717 . . . . 0.0 109.985 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.5 m -95.06 138.42 32.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.155 -0.965 . . . . 0.0 109.982 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 7.4 p -90.78 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.151 -0.968 . . . . 0.0 110.995 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' SER . . . . . 0.554 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.62 157.65 44.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.763 -0.585 . . . . 0.0 110.173 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.2 p -133.49 133.57 42.39 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.0 110.281 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.87 -165.15 14.89 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 78' ' ' PHE . 55.7 m-85 -148.15 153.12 38.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.176 -1.19 . . . . 0.0 110.207 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 95.1 mmm -138.59 152.68 48.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t -135.09 100.58 4.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 110.338 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.173 179.945 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.7 mtp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.183 0.516 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.29 132.84 43.93 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.002 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.499 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 43.1 Cg_endo -91.2 166.19 3.65 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.78 1.411 . . . . 0.0 110.668 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.459 HG22 ' HA ' ' A' ' 52' ' ' THR . 1.4 pt -144.05 179.62 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.408 -0.808 . . . . 0.0 110.154 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.528 HG11 ' CG2' ' A' ' 74' ' ' VAL . 1.0 OUTLIER -146.33 129.88 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.245 -0.909 . . . . 0.0 110.193 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.491 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.38 121.48 43.99 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.308 -0.87 . . . . 0.0 110.088 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.536 ' O ' ' CG2' ' A' ' 48' ' ' ILE . 4.2 tp -119.74 139.92 51.53 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.192 -0.943 . . . . 0.0 110.148 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.5 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.6 ttpp -142.39 167.13 22.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 0.0 110.573 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.5 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 154.74 -166.49 32.39 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.474 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 65.4 m-20 -64.65 136.73 57.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -1.233 . . . . 0.0 109.968 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.464 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.78 -46.57 59.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 111.169 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -63.51 -46.8 84.38 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.118 -0.989 . . . . 0.0 111.196 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.474 ' OG1' ' HB2' ' A' ' 10' ' ' ASP . 6.4 m -57.72 -31.19 66.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.901 -1.125 . . . . 0.0 110.383 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 11' ' ' ALA . 6.7 mt -75.06 -25.44 58.63 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -59.46 -40.63 87.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.545 -0.722 . . . . 0.0 110.294 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.466 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 22.4 t -70.12 -36.89 75.14 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.222 -0.924 . . . . 0.0 110.527 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.48 HD11 ' CD1' ' A' ' 68' ' ' ILE . 17.5 mt -58.85 -54.79 43.09 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.085 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.484 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 26.9 ttt180 -47.28 -26.29 1.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.54 -0.725 . . . . 0.0 110.762 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.473 ' C ' ' CD1' ' A' ' 19' ' ' TYR . 10.9 t80 -64.92 -50.9 64.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 0.0 110.747 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.48 -13.54 62.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.474 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.484 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 2.4 m-30 -66.33 -35.4 80.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.203 -0.936 . . . . 0.0 110.076 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -63.52 -29.83 71.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.32 -0.862 . . . . 0.0 110.261 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -74.91 -41.09 60.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.21 -0.931 . . . . 0.0 109.762 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 68.2 m-70 -95.14 37.27 1.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.32 -0.863 . . . . 0.0 109.94 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.58 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 8.7 p -57.22 -14.35 4.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.311 -0.868 . . . . 0.0 110.428 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 p -96.72 6.67 48.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.103 -0.998 . . . . 0.0 110.182 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.456 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 6.6 mp -92.39 -35.04 13.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 110.376 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.58 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 39.3 p90 -111.05 165.77 11.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.189 -0.944 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.06 -30.47 12.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.233 -0.917 . . . . 0.0 110.737 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.576 ' HB3' ' CE3' ' B' ' 37' ' ' TRP . . . -159.66 114.48 2.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.226 -0.921 . . . . 0.0 110.557 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.542 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 11.7 p -89.98 99.69 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.119 -0.988 . . . . 0.0 110.135 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.483 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -50.74 147.9 4.44 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.217 -0.927 . . . . 0.0 110.179 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t -60.82 164.47 4.75 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.085 -1.01 . . . . 0.0 109.829 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.7 121.21 15.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.173 -0.954 . . . . 0.0 110.255 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.522 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 55.7 p-90 -145.03 -177.56 5.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 109.605 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.501 ' CD2' ' C ' ' A' ' 35' ' ' TRP . 0.8 OUTLIER -162.68 170.73 17.97 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.027 -1.045 . . . . 0.0 110.422 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.513 ' CE3' ' HB3' ' B' ' 30' ' ' ALA . 26.3 m95 -79.37 105.23 10.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.337 -0.852 . . . . 0.0 110.033 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.272 -0.893 . . . . 0.0 110.315 -179.964 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.386 0.612 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.536 ' CG2' ' O ' ' A' ' 7' ' ' LEU . 19.1 mt -141.96 148.81 20.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.336 -0.852 . . . . 0.0 109.678 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.442 ' N ' HG22 ' A' ' 48' ' ' ILE . 97.2 t -126.69 113.12 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.104 -0.998 . . . . 0.0 110.654 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.414 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 94.6 m -93.86 156.88 16.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 109.809 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 50' ' ' THR . 1.6 mp -137.36 139.86 41.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.565 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.478 HG22 ' CZ2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.54 125.08 40.77 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.653 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.499 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 28.3 m-85 -107.79 148.71 29.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.445 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.51 -16.78 28.24 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 85.0 p -147.61 148.15 30.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.148 -0.97 . . . . 0.0 110.178 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.433 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 16.0 mt-10 -70.16 -36.97 75.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.209 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 43.2 t-105 -53.78 -48.0 70.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.296 -0.877 . . . . 0.0 109.988 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 55.2 tt0 -57.07 -36.05 70.09 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.312 -0.867 . . . . 0.0 110.53 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.433 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 1.1 ttp180 -59.62 -44.93 93.29 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.208 -0.933 . . . . 0.0 110.948 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -61.3 -40.58 94.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.111 -0.993 . . . . 0.0 111.391 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.419 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 56.7 mt-30 -65.42 -43.33 90.85 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.886 -1.134 . . . . 0.0 110.743 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.55 ' CE1' HG23 ' A' ' 66' ' ' VAL . 15.9 t80 -55.96 -51.72 66.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.23 -0.919 . . . . 0.0 110.789 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 43.1 mt -59.61 -14.74 14.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.199 -0.938 . . . . 0.0 110.605 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.8 t -96.44 -21.91 17.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.897 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 4.8 mt-30 -95.85 -34.19 11.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.071 -1.018 . . . . 0.0 110.438 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.55 HG23 ' CE1' ' A' ' 62' ' ' PHE . 19.5 m -87.03 109.12 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.101 -0.999 . . . . 0.0 110.624 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.3 137.33 36.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.553 HD13 ' CG2' ' A' ' 72' ' ' ILE . 18.2 tt -150.37 131.57 7.41 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.011 -1.055 . . . . 0.0 110.739 -179.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.542 ' HD2' ' CG1' ' A' ' 68' ' ' ILE . 43.6 Cg_endo -47.28 -178.39 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 124.246 1.656 . . . . 0.0 111.063 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.54 6.06 45.17 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.235 -0.915 . . . . 0.0 110.377 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.521 ' CG2' HG12 ' A' ' 72' ' ' ILE . 9.8 t -84.21 -30.38 25.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.063 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.553 ' CG2' HD13 ' A' ' 68' ' ' ILE . 17.3 mm -94.86 103.23 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.4 m -95.35 157.78 15.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.243 -0.911 . . . . 0.0 109.997 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.528 ' CG2' HG11 ' A' ' 5' ' ' VAL . 9.8 p -145.85 157.88 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.147 -0.971 . . . . 0.0 110.592 -179.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.59 -179.13 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.452 -0.78 . . . . 0.0 110.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 p -107.4 170.46 7.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.109 -0.994 . . . . 0.0 110.79 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.443 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -164.4 -174.07 33.76 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' B' ' 78' ' ' PHE . 38.6 m-85 -148.1 142.08 25.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.223 -1.163 . . . . 0.0 110.69 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 90.3 mmm -122.94 156.91 33.75 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 110.042 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -135.62 102.74 5.2 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.349 -0.844 . . . . 0.0 110.146 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.406 HG22 HD11 ' A' ' 81' ' ' ILE . 14.4 pt . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.289 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.185 0.517 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.54 132.99 42.96 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 109.964 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.507 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 44.2 Cg_endo -91.8 165.9 3.29 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.923 1.486 . . . . 0.0 110.678 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.48 HG22 ' HA ' ' B' ' 52' ' ' THR . 1.4 pt -144.18 -179.92 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.354 -0.841 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.534 HG11 ' CG2' ' B' ' 74' ' ' VAL . 1.0 OUTLIER -146.59 130.94 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.119 -0.988 . . . . 0.0 110.213 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.496 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.1 OUTLIER -106.06 121.69 44.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.124 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.527 ' O ' ' CG2' ' B' ' 48' ' ' ILE . 4.2 tp -119.79 139.94 51.54 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.216 -0.928 . . . . 0.0 110.1 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.494 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 9.9 ttpp -142.55 167.36 22.27 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.11 -0.994 . . . . 0.0 110.534 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.494 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 154.74 -166.34 32.34 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . 0.485 ' HB2' ' OG1' ' B' ' 13' ' ' THR . 67.2 m-20 -64.99 136.42 56.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.129 -1.218 . . . . 0.0 109.752 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.473 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.57 -45.53 57.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 111.297 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -64.38 -46.3 83.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.121 -0.987 . . . . 0.0 111.117 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.485 ' OG1' ' HB2' ' B' ' 10' ' ' ASP . 6.5 m -57.87 -31.57 66.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.026 -1.046 . . . . 0.0 110.345 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' B' ' 11' ' ' ALA . 6.2 mt -74.93 -25.13 58.68 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.211 -0.931 . . . . 0.0 109.548 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.58 -40.31 86.98 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.438 -0.789 . . . . 0.0 110.069 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.468 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.0 t -70.21 -37.25 75.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.308 -0.87 . . . . 0.0 110.473 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.52 HD11 ' CD1' ' B' ' 68' ' ' ILE . 17.1 mt -58.81 -54.62 45.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.19 -0.944 . . . . 0.0 110.17 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.489 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 27.6 ttt180 -47.19 -26.19 1.1 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.494 -0.754 . . . . 0.0 110.77 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.477 ' C ' ' CD1' ' B' ' 19' ' ' TYR . 11.1 t80 -65.03 -50.79 64.86 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.038 -1.039 . . . . 0.0 110.79 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.66 -13.39 62.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.168 -0.958 . . . . 0.0 110.539 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.489 ' HB2' ' O ' ' B' ' 18' ' ' ARG . 2.4 m-30 -66.48 -35.62 80.73 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.15 -0.969 . . . . 0.0 110.262 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -63.33 -29.87 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.188 -0.945 . . . . 0.0 110.37 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -74.85 -41.26 60.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.108 -0.995 . . . . 0.0 109.831 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.467 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 66.7 m-70 -95.09 37.05 1.17 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.34 -0.85 . . . . 0.0 109.861 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.586 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 7.7 p -57.07 -14.44 3.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.376 -0.827 . . . . 0.0 110.457 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 27.5 p -96.35 6.77 48.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.168 -0.957 . . . . 0.0 110.103 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.491 ' O ' ' NE2' ' B' ' 58' ' ' GLN . 6.5 mp -92.54 -35.5 13.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.315 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.586 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 37.5 p90 -110.54 166.21 11.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.147 -0.971 . . . . 0.0 110.197 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.7 -30.24 12.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.296 -0.878 . . . . 0.0 110.766 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . 0.513 ' HB3' ' CE3' ' A' ' 37' ' ' TRP . . . -159.56 114.15 2.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.13 -0.981 . . . . 0.0 110.49 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.54 ' CG1' ' O ' ' B' ' 31' ' ' VAL . 12.1 p -90.02 99.36 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.097 -1.002 . . . . 0.0 109.725 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.522 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -50.87 148.28 4.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.117 -0.99 . . . . 0.0 110.102 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' SER . . . . . 0.412 ' HB3' ' HB2' ' A' ' 35' ' ' TRP . 3.9 t -60.98 164.62 4.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.894 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.6 m -67.69 121.71 16.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.237 -0.914 . . . . 0.0 110.319 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.5 ' C ' ' CD2' ' B' ' 36' ' ' HIS . 56.6 p-90 -145.34 -177.13 5.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.149 -0.969 . . . . 0.0 109.741 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.5 ' CD2' ' C ' ' B' ' 35' ' ' TRP . 0.7 OUTLIER -162.67 170.45 18.43 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.033 -1.042 . . . . 0.0 110.41 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.576 ' CE3' ' HB3' ' A' ' 30' ' ' ALA . 26.4 m95 -79.26 104.93 10.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' THR . . . . . 0.487 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 8.8 t . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.297 -0.877 . . . . 0.0 110.185 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.3 0.571 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.527 ' CG2' ' O ' ' B' ' 7' ' ' LEU . 19.7 mt -141.64 149.16 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 109.704 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . 0.46 ' N ' HG22 ' B' ' 48' ' ' ILE . 93.1 t -126.91 113.28 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.112 -0.992 . . . . 0.0 110.626 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.419 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 97.7 m -94.26 156.86 16.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 109.899 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' B' ' 50' ' ' THR . 1.7 mp -137.22 139.84 41.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.045 -1.034 . . . . 0.0 110.623 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.48 ' HA ' HG22 ' B' ' 4' ' ' ILE . 0.0 OUTLIER -96.67 125.18 40.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.728 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.507 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 28.9 m-85 -107.99 149.08 28.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 0.0 110.528 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.84 -16.59 28.01 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.407 -0.808 . . . . 0.0 110.17 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 85.1 p -147.83 146.7 29.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.453 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 15.6 mt-10 -68.71 -37.64 79.65 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.152 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . 0.416 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 44.3 t-105 -53.7 -48.32 69.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.318 -0.864 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.491 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.5 tt0 -56.8 -35.72 69.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.408 -0.807 . . . . 0.0 110.453 -179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 1.1 ttp180 -59.83 -45.44 92.39 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.042 -1.036 . . . . 0.0 110.979 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -60.95 -40.23 92.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.163 -0.96 . . . . 0.0 111.235 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.432 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 57.4 mt-30 -65.62 -43.44 89.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.051 -1.031 . . . . 0.0 110.73 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.536 ' CE1' HG23 ' B' ' 66' ' ' VAL . 17.1 t80 -55.88 -51.66 66.79 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.286 -0.884 . . . . 0.0 110.672 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.78 -15.51 20.98 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.134 -0.979 . . . . 0.0 110.765 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 10.6 t -95.49 -21.99 17.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.117 -0.989 . . . . 0.0 110.974 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 4.6 mt-30 -95.91 -33.06 12.33 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.079 -1.013 . . . . 0.0 110.545 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.536 HG23 ' CE1' ' B' ' 62' ' ' PHE . 20.1 m -88.3 109.43 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.208 -0.932 . . . . 0.0 110.616 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.97 137.29 36.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.945 . . . . 0.0 109.507 179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.549 ' CG1' ' HD2' ' B' ' 69' ' ' PRO . 18.4 tt -150.3 131.68 7.5 Favored Pre-proline 0 C--N 1.305 -1.369 0 O-C-N 120.993 -1.067 . . . . 0.0 110.518 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.549 ' HD2' ' CG1' ' B' ' 68' ' ' ILE . 42.2 Cg_endo -47.93 -179.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.711 0 O-C-N 124.148 1.604 . . . . 0.0 110.942 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -89.48 5.75 43.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.37 -0.831 . . . . 0.0 110.481 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' THR . . . . . 0.525 ' CG2' HG12 ' B' ' 72' ' ' ILE . 9.4 t -84.17 -30.58 25.71 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.158 -0.964 . . . . 0.0 110.227 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.532 ' CG2' HD13 ' B' ' 68' ' ' ILE . 16.8 mm -94.6 103.52 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -0.926 . . . . 0.0 110.254 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 63.2 m -95.41 157.39 15.92 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.237 -0.914 . . . . 0.0 110.204 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.534 ' CG2' HG11 ' B' ' 5' ' ' VAL . 9.8 p -145.64 157.49 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.059 -1.026 . . . . 0.0 110.743 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.3 -178.99 5.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.496 -0.753 . . . . 0.0 109.875 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.5 p -107.15 171.91 7.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.102 -0.999 . . . . 0.0 110.773 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . 0.462 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -164.98 -175.1 35.4 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' A' ' 78' ' ' PHE . 36.8 m-85 -147.8 140.57 24.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -1.133 . . . . 0.0 110.462 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 89.6 mmm -121.99 157.53 31.12 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 110.033 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -135.84 103.51 5.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.239 -0.913 . . . . 0.0 110.178 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.413 HG22 HD11 ' B' ' 81' ' ' ILE . 13.8 pt . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.18 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.252 0.549 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 m -72.33 123.62 89.74 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.286 -0.884 . . . . 0.0 110.256 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.7 Cg_endo -76.92 153.06 32.6 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 O-C-N 123.947 1.498 . . . . 0.0 110.296 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 3' ' ' PRO . 0.8 OUTLIER -144.2 176.4 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.427 HG21 ' HB2' ' A' ' 51' ' ' LEU . 2.4 m -146.33 129.05 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.313 -0.867 . . . . 0.0 110.214 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.494 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 1.1 m170 -104.98 116.51 32.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.936 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.531 HD23 ' CG2' ' A' ' 72' ' ' ILE . 1.0 OUTLIER -109.75 142.51 40.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.225 -0.922 . . . . 0.0 110.142 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.463 ' HB2' HG12 ' A' ' 48' ' ' ILE . 14.9 ttpt -141.5 166.48 24.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.261 -0.899 . . . . 0.0 110.492 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.25 -160.05 29.23 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.04 136.52 56.86 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -1.183 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.99 -29.59 8.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.301 -0.874 . . . . 0.0 110.52 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -78.01 -46.3 21.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.106 -0.996 . . . . 0.0 110.173 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.427 ' O ' HD13 ' A' ' 17' ' ' LEU . 92.7 m -58.1 -14.08 6.09 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.389 -0.82 . . . . 0.0 110.419 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 47' ' ' ALA . 16.0 mt -87.62 -38.39 15.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 110.423 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.03 -37.39 79.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.221 -0.924 . . . . 0.0 110.227 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.441 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 8.0 t -70.08 -37.29 75.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.317 -0.864 . . . . 0.0 110.558 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.427 HD13 ' O ' ' A' ' 13' ' ' THR . 19.1 mt -58.75 -48.84 79.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.079 -1.013 . . . . 0.0 110.223 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.561 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 19.5 ttm180 -47.69 -37.3 12.74 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.253 -0.905 . . . . 0.0 110.253 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 18.1 t80 -64.76 -31.25 72.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 0.0 110.627 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.419 ' NH1' ' HE3' ' A' ' 67' ' ' LYS . 6.2 mmt180 -70.42 -30.54 67.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.147 -0.971 . . . . 0.0 110.205 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.561 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.1 m-30 -66.63 -17.26 64.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.894 . . . . 0.0 110.327 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.8 mmtt -63.63 -33.0 74.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.305 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.509 ' O ' ' ND1' ' A' ' 24' ' ' HIS . 4.1 mmtp -75.03 -10.87 59.88 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.205 -0.934 . . . . 0.0 110.225 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.528 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . 8.0 m-70 -144.7 46.32 1.37 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.215 -0.928 . . . . 0.0 109.928 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 11.3 t -57.43 -14.87 5.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.464 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -96.48 17.01 17.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.139 -0.976 . . . . 0.0 110.325 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.528 ' CD2' ' HB3' ' A' ' 24' ' ' HIS . 5.0 mp -92.41 -35.11 13.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.248 -0.908 . . . . 0.0 110.017 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.499 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 16.8 p90 -108.03 172.75 6.66 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.208 -0.933 . . . . 0.0 109.994 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 96.4 m -99.82 -32.05 11.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.198 -0.938 . . . . 0.0 111.372 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.75 119.89 3.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.859 -1.151 . . . . 0.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.423 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 9.4 p -89.1 114.9 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 109.655 179.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.614 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -83.79 152.78 24.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.149 -0.969 . . . . 0.0 110.671 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.4 p -61.36 164.79 5.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.322 -0.861 . . . . 0.0 110.425 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 m -68.12 126.17 28.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.355 -0.841 . . . . 0.0 110.239 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.592 ' CZ3' ' CB ' ' B' ' 32' ' ' SER . 1.6 p-90 -145.46 164.4 31.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.042 -1.036 . . . . 0.0 109.438 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.426 ' C ' ' CD2' ' A' ' 36' ' ' HIS . 2.0 p-80 -162.45 -178.72 6.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.967 -1.083 . . . . 0.0 110.973 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.553 ' CH2' HG23 ' B' ' 52' ' ' THR . 33.7 m95 -79.55 126.49 30.94 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.525 -0.734 . . . . 0.0 110.664 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.477 ' HB ' ' O ' ' A' ' 37' ' ' TRP . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.329 -0.857 . . . . 0.0 110.063 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.43 ' O ' HD12 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.194 0.521 . . . . 0.0 110.156 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.463 HG12 ' HB2' ' A' ' 8' ' ' LYS . 20.0 mt -142.49 147.31 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 0.0 110.248 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.442 ' N ' HG22 ' A' ' 48' ' ' ILE . 21.3 t -125.36 119.93 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.294 -0.879 . . . . 0.0 110.234 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.494 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 16.0 m -94.22 151.86 19.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.256 -0.902 . . . . 0.0 110.132 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.427 ' HB2' HG21 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -137.08 131.73 33.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 110.07 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.591 HG23 ' CH2' ' B' ' 37' ' ' TRP . 40.2 p -97.77 136.37 38.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -0.833 . . . . 0.0 110.239 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.561 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 37.5 m-85 -116.16 153.99 30.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.0 110.125 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -89.92 -13.88 35.37 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.25 -0.907 . . . . 0.0 110.768 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.572 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 1.7 m -142.28 151.13 41.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.044 -1.035 . . . . 0.0 110.221 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -70.97 -53.9 13.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.668 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 6.9 p90 -54.03 -35.16 61.64 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.098 -1.001 . . . . 0.0 110.063 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.668 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 33.3 tt0 -56.89 -37.76 71.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 110.024 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -59.59 -40.21 86.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -61.08 -40.36 93.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.329 -0.857 . . . . 0.0 110.458 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.469 ' O ' ' OG ' ' A' ' 64' ' ' SER . 64.4 mt-30 -65.66 -40.68 92.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.224 -0.923 . . . . 0.0 110.36 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.407 ' HA ' HD23 ' A' ' 27' ' ' LEU . 85.9 t80 -55.7 -39.81 71.54 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.108 -0.995 . . . . 0.0 109.531 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.2 mt -58.89 -27.64 65.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.389 -0.819 . . . . 0.0 109.713 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 8.5 p -96.37 -6.21 38.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 109.794 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 20.0 mm-40 -95.23 -28.36 15.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.394 -0.817 . . . . 0.0 109.741 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.464 ' CG2' ' O ' ' A' ' 66' ' ' VAL . 33.3 m -131.26 85.47 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.324 -0.86 . . . . 0.0 109.863 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 66' ' ' VAL . 7.4 pttp -41.85 135.82 2.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.237 -0.914 . . . . 0.0 110.423 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.475 HG21 ' HD2' ' A' ' 69' ' ' PRO . 1.4 mp -88.41 148.69 42.94 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.369 -0.832 . . . . 0.0 110.126 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.527 ' CG ' ' CG1' ' A' ' 72' ' ' ILE . 46.3 Cg_endo -70.81 -160.06 0.07 OUTLIER 'Trans proline' 0 C--N 1.302 -1.872 0 O-C-N 124.163 1.612 . . . . 0.0 110.579 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.42 ' O ' HG22 ' A' ' 71' ' ' THR . 0.3 OUTLIER -104.9 24.61 11.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.42 HG22 ' O ' ' A' ' 70' ' ' LYS . 1.9 p -154.42 3.15 0.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 111.441 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.531 ' CG2' HD23 ' A' ' 7' ' ' LEU . 9.6 mm -95.12 121.16 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.807 -1.183 . . . . 0.0 109.901 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 1.7 m -94.86 129.81 41.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 110.29 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 74' ' ' VAL . 2.9 p -112.02 100.37 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.476 -0.765 . . . . 0.0 109.822 178.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.02 175.99 5.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.746 -1.221 . . . . 0.0 110.536 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.9 p -109.06 153.26 23.9 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.025 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.16 178.36 38.0 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -147.84 139.14 23.58 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.269 -1.136 . . . . 0.0 110.263 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.417 ' SD ' ' CE1' ' B' ' 6' ' ' HIS . 2.1 mtm -126.01 138.21 53.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.108 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.26 101.82 6.91 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.23 -0.918 . . . . 0.0 110.336 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.19 179.879 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.244 0.545 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 3.0 m -71.96 123.76 89.91 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 110.279 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -76.97 153.21 32.47 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 123.997 1.525 . . . . 0.0 110.262 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.486 HG22 ' O ' ' B' ' 3' ' ' PRO . 0.7 OUTLIER -144.28 176.07 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.324 -0.86 . . . . 0.0 110.245 179.822 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.411 HG21 ' HB2' ' B' ' 51' ' ' LEU . 2.5 m -146.05 128.86 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.33 -0.856 . . . . 0.0 110.179 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.469 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.1 m170 -104.57 118.57 36.92 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.255 -0.903 . . . . 0.0 109.624 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.529 HD23 ' CG2' ' B' ' 72' ' ' ILE . 1.0 OUTLIER -111.69 142.37 44.11 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.426 -0.796 . . . . 0.0 110.139 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.456 ' HB2' HG12 ' B' ' 48' ' ' ILE . 15.0 ttpt -141.64 166.05 25.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.85 -160.14 29.48 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.98 136.17 56.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.279 -1.13 . . . . 0.0 110.158 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.83 -30.19 9.37 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.271 -0.893 . . . . 0.0 110.305 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -76.82 -46.76 23.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.254 -0.904 . . . . 0.0 110.223 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -57.96 -15.24 8.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.32 -0.862 . . . . 0.0 110.533 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.438 HD12 ' O ' ' B' ' 47' ' ' ALA . 16.6 mt -86.4 -38.07 17.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 110.561 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.1 -37.53 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.199 -0.938 . . . . 0.0 110.325 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.463 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 8.4 t -69.93 -37.22 75.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.919 . . . . 0.0 110.344 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 19.8 mt -58.69 -49.03 79.07 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.231 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.561 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 19.1 ttm180 -47.93 -36.62 12.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.409 -0.807 . . . . 0.0 110.151 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.463 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 21.9 t80 -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.427 -0.796 . . . . 0.0 110.503 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.424 ' NH1' ' HE3' ' B' ' 67' ' ' LYS . 6.3 mmt180 -69.83 -31.05 68.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.228 -0.92 . . . . 0.0 110.33 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.561 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.2 m-30 -66.4 -17.21 64.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.199 -0.938 . . . . 0.0 110.317 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -63.46 -32.83 74.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.26 -0.9 . . . . 0.0 110.191 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . 0.507 ' O ' ' ND1' ' B' ' 24' ' ' HIS . 4.0 mmtp -75.26 -10.67 59.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.208 -0.933 . . . . 0.0 110.214 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.534 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 8.6 m-70 -145.06 46.46 1.33 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.229 -0.919 . . . . 0.0 109.998 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.533 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 13.9 t -57.29 -14.54 4.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.258 -0.902 . . . . 0.0 110.565 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -96.59 16.26 19.35 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.251 -0.905 . . . . 0.0 110.294 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.534 ' CD2' ' HB3' ' B' ' 24' ' ' HIS . 5.2 mp -92.12 -34.08 14.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 110.025 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.533 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 17.1 p90 -108.37 172.54 6.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.9 . . . . 0.0 110.048 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -99.97 -32.11 11.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.157 -0.965 . . . . 0.0 111.283 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.86 119.88 2.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.899 -1.126 . . . . 0.0 111.013 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.427 ' O ' ' CG1' ' B' ' 31' ' ' VAL . 11.3 p -89.46 115.2 28.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.277 -0.889 . . . . 0.0 109.567 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.592 ' CB ' ' CZ3' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -83.92 153.34 24.01 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.204 -0.935 . . . . 0.0 110.74 -179.417 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 60.3 p -61.56 164.44 5.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.328 -0.858 . . . . 0.0 110.314 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -68.05 126.45 29.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.287 -0.883 . . . . 0.0 110.25 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.614 ' CZ3' ' CB ' ' A' ' 32' ' ' SER . 1.7 p-90 -145.71 164.93 30.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.014 -1.054 . . . . 0.0 109.567 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.417 ' CD2' ' C ' ' B' ' 36' ' ' HIS . 2.0 p-80 -162.46 -177.91 5.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.951 -1.093 . . . . 0.0 110.972 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.591 ' CH2' HG23 ' A' ' 52' ' ' THR . 34.1 m95 -79.87 127.0 31.72 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.415 -0.803 . . . . 0.0 110.507 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' THR . . . . . 0.49 ' HB ' ' O ' ' B' ' 37' ' ' TRP . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.271 -0.893 . . . . 0.0 110.167 179.492 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.438 ' O ' HD12 ' B' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.159 0.504 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.456 HG12 ' HB2' ' B' ' 8' ' ' LYS . 20.1 mt -142.48 146.84 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.274 -0.891 . . . . 0.0 110.318 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . 0.428 ' N ' HG22 ' B' ' 48' ' ' ILE . 21.4 t -124.65 120.31 58.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.469 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 16.7 m -94.35 151.22 19.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.073 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.411 ' HB2' HG21 ' B' ' 5' ' ' VAL . 0.2 OUTLIER -136.83 131.76 33.7 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.927 . . . . 0.0 110.165 179.709 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.553 HG23 ' CH2' ' A' ' 37' ' ' TRP . 40.8 p -98.01 136.2 38.62 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.368 -0.833 . . . . 0.0 110.364 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.561 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 37.6 m-85 -116.18 154.13 30.6 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 110.147 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -90.07 -14.38 33.92 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.175 -0.953 . . . . 0.0 110.736 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' SER . . . . . 0.589 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 1.7 m -141.39 151.73 43.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.105 -0.997 . . . . 0.0 110.21 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -71.92 -53.55 12.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.23 -0.919 . . . . 0.0 110.37 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . 0.67 ' CD1' ' N ' ' B' ' 58' ' ' GLN . 6.3 p90 -53.92 -34.84 60.74 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.109 -0.995 . . . . 0.0 109.945 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.67 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 32.5 tt0 -57.0 -38.31 72.91 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.08 -1.012 . . . . 0.0 110.033 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -59.48 -39.71 84.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.226 -0.921 . . . . 0.0 109.927 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -61.31 -39.97 92.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.317 -0.865 . . . . 0.0 110.216 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.467 ' O ' ' OG ' ' B' ' 64' ' ' SER . 65.3 mt-30 -65.85 -41.31 91.87 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.475 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -55.62 -39.5 70.89 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.196 -0.94 . . . . 0.0 109.53 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 67.1 mt -58.89 -27.25 65.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.472 -0.767 . . . . 0.0 109.827 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.467 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 6.5 p -96.95 -6.11 36.32 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.368 -0.832 . . . . 0.0 109.92 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . 0.461 ' OE1' HD21 ' B' ' 27' ' ' LEU . 19.5 mm-40 -95.13 -29.01 14.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.33 -0.856 . . . . 0.0 109.659 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.456 ' CG2' ' O ' ' B' ' 66' ' ' VAL . 33.1 m -130.55 86.69 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.443 -0.786 . . . . 0.0 109.79 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . 0.424 ' HE3' ' NH1' ' B' ' 20' ' ' ARG . 6.9 pttp -43.15 136.18 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.242 -0.911 . . . . 0.0 110.278 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.465 HG21 ' HD2' ' B' ' 69' ' ' PRO . 1.4 mp -88.49 148.61 42.58 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.24 -0.912 . . . . 0.0 109.992 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.525 ' CG ' ' CG1' ' B' ' 72' ' ' ILE . 45.0 Cg_endo -71.0 -160.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.1 1.579 . . . . 0.0 110.553 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.468 ' O ' HG22 ' B' ' 71' ' ' THR . 0.4 OUTLIER -104.43 24.77 11.1 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.136 -0.978 . . . . 0.0 110.44 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' THR . . . . . 0.468 HG22 ' O ' ' B' ' 70' ' ' LYS . 2.1 p -154.49 3.67 0.24 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.15 -0.969 . . . . 0.0 111.397 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.529 ' CG2' HD23 ' B' ' 7' ' ' LEU . 9.8 mm -95.48 121.49 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.774 -1.204 . . . . 0.0 109.917 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' THR . . . . . 0.469 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 1.6 m -95.28 129.61 42.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.202 -0.936 . . . . 0.0 110.394 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.439 ' O ' HG13 ' B' ' 74' ' ' VAL . 2.6 p -111.65 99.86 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.497 -0.752 . . . . 0.0 109.803 178.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.92 174.86 5.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.656 -1.278 . . . . 0.0 110.424 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.1 p -107.8 152.93 23.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.402 -0.811 . . . . 0.0 110.149 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -161.45 178.49 37.34 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -147.97 139.39 23.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.25 -1.147 . . . . 0.0 110.256 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.0 mtm -126.36 139.14 53.52 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.13 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.89 101.71 6.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.416 ' OXT' HG23 ' B' ' 81' ' ' ILE . 4.1 mt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.07 -0.966 . . . . 0.0 110.207 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.445 ' HB3' ' HB3' ' A' ' 78' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.297 0.57 . . . . 0.0 110.138 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 66.8 p -96.23 106.68 30.4 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.384 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -52.82 155.7 10.42 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 O-C-N 124.034 1.544 . . . . 0.0 110.315 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.414 HG12 ' C ' ' A' ' 77' ' ' GLY . 7.1 pt -143.47 178.69 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.534 HG13 ' CG1' ' A' ' 74' ' ' VAL . 40.3 t -145.53 136.04 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.281 -0.887 . . . . 0.0 110.381 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.522 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.54 121.4 43.88 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.329 -0.857 . . . . 0.0 109.795 179.647 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.461 ' HB2' HG12 ' A' ' 49' ' ' VAL . 0.4 OUTLIER -115.51 123.81 49.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.546 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.521 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 18.8 tttt -141.48 166.22 25.35 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.236 -0.915 . . . . 0.0 110.209 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.521 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 141.88 -146.07 16.87 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.92 121.38 14.51 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.322 -1.105 . . . . 0.0 110.332 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.18 -35.96 28.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.354 -0.841 . . . . 0.0 110.733 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -75.01 -43.79 51.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.154 -0.966 . . . . 0.0 110.64 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.435 ' O ' HD11 ' A' ' 17' ' ' LEU . 47.6 m -57.86 -27.01 62.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.206 -0.934 . . . . 0.0 110.507 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.421 ' CD2' HD11 ' A' ' 72' ' ' ILE . 15.7 mt -82.67 -34.45 27.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -59.78 -39.12 83.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 110.117 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.485 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 35.9 t -70.21 -37.84 75.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.407 -0.808 . . . . 0.0 110.571 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.435 HD11 ' O ' ' A' ' 13' ' ' THR . 22.7 mt -58.66 -50.56 73.41 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.086 -1.009 . . . . 0.0 110.166 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.1 ttm105 -46.98 -29.15 1.91 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.367 -0.833 . . . . 0.0 110.307 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.485 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 72.0 t80 -64.81 -42.12 95.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.234 -0.916 . . . . 0.0 110.503 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 mtt-85 -70.99 -26.24 63.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.926 . . . . 0.0 110.157 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.581 ' CE1' HG12 ' A' ' 66' ' ' VAL . 9.1 m-30 -66.55 -20.37 66.0 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.217 -0.927 . . . . 0.0 110.398 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -63.29 -27.7 69.51 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.224 -0.923 . . . . 0.0 110.42 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.6 mmtm -75.13 -48.4 23.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.476 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.408 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 20.1 m-70 -94.84 52.85 1.53 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.204 -0.935 . . . . 0.0 110.228 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.4 p -57.7 -13.65 4.38 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.154 -0.966 . . . . 0.0 110.742 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.86 13.4 28.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.025 -1.047 . . . . 0.0 110.699 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.423 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 3.6 mt -92.06 -45.11 8.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.122 -0.986 . . . . 0.0 110.089 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.631 ' CE2' ' CG2' ' A' ' 31' ' ' VAL . 28.6 p90 -106.12 172.66 6.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.328 -0.857 . . . . 0.0 109.584 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -100.41 -35.52 9.54 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.864 -1.148 . . . . 0.0 110.99 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 119.84 2.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.091 -1.006 . . . . 0.0 110.81 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.631 ' CG2' ' CE2' ' A' ' 28' ' ' TYR . 47.1 t -88.42 99.96 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.309 -0.869 . . . . 0.0 110.18 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.769 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -62.12 151.28 36.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 111.663 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.456 ' OG ' ' N ' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -61.69 159.1 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.441 -0.787 . . . . 0.0 109.761 179.023 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.2 127.6 33.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.771 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 58.6 p-90 -146.39 120.63 9.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.085 -1.009 . . . . 0.0 110.634 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.631 ' CD2' ' N ' ' A' ' 37' ' ' TRP . 20.2 t60 -78.94 166.44 22.38 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.032 -1.043 . . . . 0.0 109.913 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.631 ' N ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -78.41 50.7 0.96 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.817 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.589 HG21 ' CD2' ' A' ' 36' ' ' HIS . 13.0 t . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.149 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.231 0.538 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.516 ' O ' ' O ' ' A' ' 35' ' ' TRP . 80.1 mt -142.27 133.75 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.22 -0.925 . . . . 0.0 110.068 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.508 ' CG2' ' O ' ' A' ' 32' ' ' SER . 0.3 OUTLIER -125.14 -179.38 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.9 -1.125 . . . . 0.0 110.308 -179.932 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.412 ' N ' HG11 ' A' ' 49' ' ' VAL . 16.8 m -145.06 158.2 43.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.409 -0.807 . . . . 0.0 109.818 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.0 mt -135.04 131.52 37.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.231 -0.918 . . . . 0.0 110.009 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.447 ' CG2' ' CZ2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.83 130.56 44.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 110.263 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -117.8 152.86 34.48 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.387 -0.82 . . . . 0.0 109.986 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -95.48 -18.35 20.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.362 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 77.3 p -145.43 140.44 27.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -61.12 -39.58 90.55 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 0.0 110.226 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.9 t-105 -53.96 -50.45 66.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.286 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.423 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 60.2 tt0 -57.27 -40.1 77.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.424 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.439 ' HD2' HD13 ' A' ' 63' ' ' LEU . 5.1 tmm_? -59.32 -38.99 81.7 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.128 -0.983 . . . . 0.0 110.168 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -61.34 -41.42 97.01 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.865 . . . . 0.0 110.53 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.465 ' O ' ' OG ' ' A' ' 64' ' ' SER . 50.2 mt-30 -65.7 -40.08 91.91 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.159 -0.963 . . . . 0.0 110.201 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.477 ' CE2' HG22 ' A' ' 66' ' ' VAL . 68.3 t80 -55.76 -42.07 74.92 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.263 -0.898 . . . . 0.0 109.942 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.439 HD13 ' HD2' ' A' ' 59' ' ' ARG . 12.0 mt -59.44 -24.0 63.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' SER . . . . . 0.465 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 3.7 p -100.08 -7.89 24.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 110.179 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -97.07 -29.31 13.7 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.314 -0.867 . . . . 0.0 109.818 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.581 HG12 ' CE1' ' A' ' 21' ' ' PHE . 19.1 m -110.04 85.36 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.644 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -35.59 104.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.557 -0.715 . . . . 0.0 110.479 -179.517 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 66' ' ' VAL . 82.3 mt -87.67 115.03 61.61 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.176 -0.953 . . . . 0.0 110.467 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -63.4 -158.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 124.073 1.565 . . . . 0.0 110.082 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -106.54 -13.1 15.42 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.108 -0.995 . . . . 0.0 110.328 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.2 p -84.59 -21.97 30.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.421 HD11 ' CD2' ' A' ' 14' ' ' LEU . 25.1 mm -93.75 108.34 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.285 -0.884 . . . . 0.0 109.858 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.7 m -96.14 153.72 17.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.192 -0.943 . . . . 0.0 110.241 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.534 ' CG1' HG13 ' A' ' 5' ' ' VAL . 6.9 t -145.26 156.17 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.228 -0.92 . . . . 0.0 110.717 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -138.42 -179.07 5.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.51 -0.744 . . . . 0.0 110.061 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.462 ' O ' ' HB3' ' B' ' 80' ' ' SER . 1.6 p -106.31 154.54 20.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.201 -0.937 . . . . 0.0 110.467 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.414 ' C ' HG12 ' A' ' 4' ' ' ILE . . . -161.13 175.3 37.78 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.445 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 79.7 m-85 -147.92 137.88 22.68 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.182 -1.187 . . . . 0.0 110.44 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 7.9 mtt -115.14 162.2 17.37 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.342 -0.849 . . . . 0.0 109.814 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.4 t -118.66 99.37 6.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.23 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 1.7 pt . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.248 179.935 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.436 ' HB3' ' HB3' ' B' ' 78' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.213 0.53 . . . . 0.0 110.224 . . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 63.6 p -96.77 106.5 30.72 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.204 -0.935 . . . . 0.0 110.308 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.408 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 48.4 Cg_endo -52.54 155.96 9.3 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.021 1.538 . . . . 0.0 110.302 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.429 HG12 ' C ' ' B' ' 77' ' ' GLY . 7.6 pt -143.4 178.48 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.203 -0.936 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.539 HG13 ' CG1' ' B' ' 74' ' ' VAL . 39.8 t -145.64 136.04 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.878 . . . . 0.0 110.257 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.518 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.94 121.1 43.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.365 -0.834 . . . . 0.0 109.783 179.857 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.47 ' HB2' HG12 ' B' ' 49' ' ' VAL . 0.5 OUTLIER -115.08 124.23 51.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.57 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.519 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 18.8 tttt -141.38 166.08 25.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -0.879 . . . . 0.0 110.196 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.519 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 142.04 -146.3 17.21 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.68 121.85 15.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.346 -1.091 . . . . 0.0 110.324 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.71 -35.49 31.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 110.725 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -75.42 -43.59 49.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.175 -0.953 . . . . 0.0 110.561 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.411 ' O ' HD11 ' B' ' 17' ' ' LEU . 44.4 m -57.86 -28.18 63.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.173 -0.954 . . . . 0.0 110.403 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.466 ' HG ' HD11 ' B' ' 72' ' ' ILE . 13.0 mt -81.9 -34.66 29.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.077 -1.015 . . . . 0.0 110.117 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -59.74 -38.85 82.88 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.326 -0.859 . . . . 0.0 110.171 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.483 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 36.3 t -70.2 -37.71 75.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 0.0 110.485 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.411 HD11 ' O ' ' B' ' 13' ' ' THR . 23.0 mt -58.76 -50.61 73.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.142 -0.974 . . . . 0.0 110.107 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -47.16 -28.65 1.91 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.433 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.483 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 72.0 t80 -64.84 -41.92 95.34 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.317 -0.864 . . . . 0.0 110.469 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 26.2 mtt-85 -71.27 -26.42 62.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.0 110.364 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.581 ' CE1' HG12 ' B' ' 66' ' ' VAL . 8.5 m-30 -66.64 -20.17 65.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.27 -0.894 . . . . 0.0 110.359 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -63.38 -27.44 69.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.139 -0.976 . . . . 0.0 110.459 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -75.16 -48.32 24.18 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.264 -0.898 . . . . 0.0 110.512 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 18.9 m-70 -94.93 52.88 1.51 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.249 -0.907 . . . . 0.0 110.22 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 p -57.47 -13.72 3.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.29 -0.881 . . . . 0.0 110.558 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.96 13.58 28.42 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.128 -0.982 . . . . 0.0 110.817 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.425 ' O ' ' NE2' ' B' ' 58' ' ' GLN . 3.6 mt -92.32 -44.13 8.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.071 -1.018 . . . . 0.0 109.97 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.628 ' CE2' ' CG2' ' B' ' 31' ' ' VAL . 27.8 p90 -107.14 173.33 6.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.256 -0.903 . . . . 0.0 109.536 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.2 m -100.86 -35.79 9.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.054 -1.029 . . . . 0.0 110.919 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.76 119.86 2.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.165 -0.959 . . . . 0.0 110.684 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.628 ' CG2' ' CE2' ' B' ' 28' ' ' TYR . 48.5 t -88.19 99.68 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.089 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.771 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -60.78 150.13 33.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 111.485 -179.49 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' SER . . . . . 0.443 ' OG ' ' N ' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -61.7 159.65 13.1 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.551 -0.718 . . . . 0.0 109.575 179.107 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.25 127.41 32.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.036 -1.04 . . . . 0.0 110.616 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.769 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 58.4 p-90 -146.22 120.73 9.72 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.024 -1.047 . . . . 0.0 110.701 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.636 ' CD2' ' N ' ' B' ' 37' ' ' TRP . 20.9 t60 -78.86 166.48 22.38 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.933 -1.104 . . . . 0.0 109.902 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.636 ' N ' ' CD2' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -78.57 50.93 1.01 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.102 -0.998 . . . . 0.0 110.129 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' THR . . . . . 0.578 HG21 ' CD2' ' B' ' 36' ' ' HIS . 13.6 t . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.32 -0.863 . . . . 0.0 110.184 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.321 0.581 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.528 ' O ' ' O ' ' B' ' 35' ' ' TRP . 85.3 mt -142.38 134.23 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.326 -0.859 . . . . 0.0 109.799 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . 0.526 ' CG2' ' O ' ' B' ' 32' ' ' SER . 0.3 OUTLIER -125.91 -179.4 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.841 -1.162 . . . . 0.0 110.306 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 17.1 m -145.03 158.43 43.82 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.318 -0.863 . . . . 0.0 109.97 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -134.97 131.44 37.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.23 -0.919 . . . . 0.0 109.982 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.554 ' CG2' ' CZ2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.62 130.77 43.76 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.313 -0.867 . . . . 0.0 110.167 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.408 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 35.5 m-85 -118.07 153.3 33.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.346 -0.846 . . . . 0.0 110.003 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -95.4 -18.49 20.69 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.25 -0.906 . . . . 0.0 110.397 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 p -145.32 140.33 27.66 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.152 -0.967 . . . . 0.0 110.307 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.1 -39.3 89.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.288 -0.883 . . . . 0.0 110.044 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -54.12 -50.99 65.64 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.232 -0.917 . . . . 0.0 110.237 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.425 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 60.9 tt0 -57.08 -39.7 75.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.409 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.445 ' HD2' HD13 ' B' ' 63' ' ' LEU . 5.1 tmm_? -59.69 -38.86 82.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.085 -1.009 . . . . 0.0 110.006 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.416 -0.803 . . . . 0.0 110.441 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.457 ' O ' ' OG ' ' B' ' 64' ' ' SER . 52.0 mt-30 -65.83 -40.0 91.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.252 -0.905 . . . . 0.0 110.283 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.458 ' CE2' HG22 ' B' ' 66' ' ' VAL . 69.5 t80 -55.83 -41.68 74.6 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 109.754 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . 0.445 HD13 ' HD2' ' B' ' 59' ' ' ARG . 13.0 mt -59.51 -24.58 63.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.336 -0.852 . . . . 0.0 110.049 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.457 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 3.9 p -99.87 -7.9 24.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.299 -0.876 . . . . 0.0 110.144 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . 0.408 ' NE2' ' CD1' ' B' ' 27' ' ' LEU . 3.5 mt-30 -97.08 -29.13 13.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.303 -0.873 . . . . 0.0 109.881 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.581 HG12 ' CE1' ' B' ' 21' ' ' PHE . 20.3 m -110.0 83.58 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.323 -0.861 . . . . 0.0 109.912 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . 0.55 ' CG ' ' O ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -33.47 104.14 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.497 -0.752 . . . . 0.0 110.627 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.484 HG13 ' O ' ' B' ' 66' ' ' VAL . 84.8 mt -87.89 114.49 59.38 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 110.534 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.75 -159.03 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.845 0 O-C-N 124.211 1.637 . . . . 0.0 110.236 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -106.24 -12.84 15.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.184 -0.948 . . . . 0.0 110.492 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 29.9 p -84.69 -21.97 29.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.161 -0.962 . . . . 0.0 110.13 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.466 HD11 ' HG ' ' B' ' 14' ' ' LEU . 24.8 mm -94.12 108.5 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.287 -0.883 . . . . 0.0 109.751 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -96.09 153.64 17.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.109 -0.995 . . . . 0.0 110.07 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.539 ' CG1' HG13 ' B' ' 5' ' ' VAL . 6.0 t -144.99 155.98 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.107 -0.995 . . . . 0.0 110.546 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 3.3 t -138.6 -178.92 5.52 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.154 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -106.15 154.04 21.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.306 -0.871 . . . . 0.0 110.592 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . 0.429 ' C ' HG12 ' B' ' 4' ' ' ILE . . . -160.75 174.91 37.47 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.436 ' HB3' ' HB3' ' B' ' 1' ' ' MET . 80.1 m-85 -147.99 138.07 22.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.212 -1.169 . . . . 0.0 110.416 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 7.7 mtt -115.3 161.69 18.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.208 -0.933 . . . . 0.0 109.935 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.462 ' HB3' ' O ' ' A' ' 76' ' ' THR . 13.1 t -118.37 98.95 6.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.184 -0.948 . . . . 0.0 110.168 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 1.6 pt . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.069 179.827 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 mtp . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.253 0.549 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.476 ' O ' HG21 ' A' ' 2' ' ' THR . 5.5 t -100.95 103.83 27.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.274 -0.891 . . . . 0.0 110.419 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 48.8 Cg_endo -49.33 157.94 1.83 Allowed 'Trans proline' 0 C--N 1.305 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.238 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.467 ' CD1' ' O ' ' A' ' 4' ' ' ILE . 2.3 pp -143.91 119.02 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.131 -0.981 . . . . 0.0 110.488 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.453 HG12 HG21 ' A' ' 74' ' ' VAL . 1.2 t -94.08 136.57 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.226 -0.921 . . . . 0.0 110.257 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.54 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.47 138.62 41.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.301 -0.874 . . . . 0.0 109.695 179.529 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.46 ' HG ' ' CG2' ' A' ' 72' ' ' ILE . 0.3 OUTLIER -129.57 131.13 46.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.958 -1.089 . . . . 0.0 110.569 -179.55 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 14.4 ttpp -141.52 167.02 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.29 -0.881 . . . . 0.0 109.951 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.432 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 145.6 -151.06 23.31 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.781 -1.327 . . . . 0.0 109.781 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.411 ' O ' ' HB ' ' A' ' 13' ' ' THR . 8.3 m-20 -65.33 127.22 30.88 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.317 -1.108 . . . . 0.0 110.715 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.32 -68.81 0.14 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 0.0 110.398 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -46.0 -43.61 14.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 110.177 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.475 ' O ' HD12 ' A' ' 17' ' ' LEU . 22.3 m -57.94 -18.25 22.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 110.104 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.496 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 19.7 mt -91.53 -29.88 16.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.306 -0.871 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.0 mmtt -59.03 -41.43 87.77 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.204 -0.935 . . . . 0.0 110.481 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 t -69.74 -36.49 75.89 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.381 -0.824 . . . . 0.0 110.547 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.496 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 46.0 mt -58.92 -54.49 46.55 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.04 -1.038 . . . . 0.0 110.36 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -45.81 -32.1 2.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.307 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.82 -29.34 70.29 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.215 -0.928 . . . . 0.0 110.213 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -69.87 -21.8 63.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.025 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.441 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.2 m-30 -66.47 -36.41 82.68 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 110.045 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -63.61 -33.79 76.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.429 -0.795 . . . . 0.0 110.218 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -74.96 -9.43 58.53 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.207 -0.933 . . . . 0.0 109.863 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -145.04 43.53 1.33 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.831 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.47 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.8 t -57.74 -8.58 0.95 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.421 -0.8 . . . . 0.0 111.039 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.6 p -95.78 7.69 45.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.93 -1.106 . . . . 0.0 110.292 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.509 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 5.0 mt -92.33 -54.87 3.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 0.0 109.864 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.47 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 31.7 p90 -93.65 169.84 10.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.1 m -100.61 -33.24 10.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.081 -1.012 . . . . 0.0 110.811 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.49 114.7 2.44 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.959 -1.088 . . . . 0.0 110.748 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' ' 31' ' ' VAL . 20.5 m -90.57 112.9 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 110.187 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.567 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -68.45 147.94 51.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.157 -0.964 . . . . 0.0 110.342 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -61.5 159.64 12.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.433 ' HA ' HG21 ' A' ' 49' ' ' VAL . 91.7 m -68.18 134.86 51.16 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.356 -0.84 . . . . 0.0 110.447 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.587 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 60.2 p-90 -146.66 -178.39 6.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 0.0 109.564 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.576 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 70.6 t60 -162.43 174.23 13.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.893 -1.129 . . . . 0.0 110.66 -179.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 74.7 m95 -78.65 103.41 8.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.274 -0.891 . . . . 0.0 110.281 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.349 -0.844 . . . . 0.0 110.217 179.983 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.487 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.373 0.606 . . . . 0.0 110.567 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.531 ' N ' ' O ' ' A' ' 35' ' ' TRP . 45.9 mt -143.85 148.48 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.41 -0.806 . . . . 0.0 109.939 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.433 HG21 ' HA ' ' A' ' 34' ' ' THR . 0.4 OUTLIER -128.16 -179.48 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.1 -1.0 . . . . 0.0 110.276 -179.899 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.507 HG23 ' N ' ' A' ' 51' ' ' LEU . 96.4 m -145.98 154.05 41.47 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.256 -0.903 . . . . 0.0 110.009 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.507 ' N ' HG23 ' A' ' 50' ' ' THR . 17.7 mt -132.91 124.09 27.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.148 -0.97 . . . . 0.0 110.24 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 132.88 42.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.28 -0.887 . . . . 0.0 110.263 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.509 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 45.0 m-85 -117.73 153.87 32.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -0.876 . . . . 0.0 110.188 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -85.25 -9.99 57.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 110.574 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -162.46 160.43 26.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.135 -0.978 . . . . 0.0 110.238 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -70.99 -37.85 72.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.18 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -53.97 -52.38 60.87 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 21.5 tt0 -58.08 -36.03 72.26 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.335 -0.853 . . . . 0.0 110.624 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp85 -59.13 -54.13 50.46 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.101 -0.999 . . . . 0.0 110.601 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -61.05 -26.34 67.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.201 -0.937 . . . . 0.0 110.364 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 46.7 mt-30 -65.54 -54.89 21.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 109.785 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.556 ' CE1' ' CG2' ' A' ' 66' ' ' VAL . 1.8 t80 -55.63 -39.74 71.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.905 . . . . 0.0 109.832 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.2 mt -59.19 -23.64 62.42 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 110.068 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.71 -18.69 21.06 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.31 -0.869 . . . . 0.0 110.149 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -93.93 -9.05 38.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.178 -0.951 . . . . 0.0 109.89 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.556 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 34.0 m -136.41 133.09 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.367 -0.833 . . . . 0.0 109.811 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 103.08 11.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.241 -0.912 . . . . 0.0 109.785 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.547 ' CG2' ' HD2' ' A' ' 69' ' ' PRO . 18.1 mt -88.08 130.94 44.4 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.437 -0.789 . . . . 0.0 110.336 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.547 ' HD2' ' CG2' ' A' ' 68' ' ' ILE . 41.6 Cg_endo -40.53 162.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.639 0 O-C-N 123.969 1.51 . . . . 0.0 110.463 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -74.99 3.35 8.5 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.298 -0.876 . . . . 0.0 110.882 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -24.87 28.79 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.043 -1.035 . . . . 0.0 109.842 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.512 HD13 ' CG2' ' A' ' 68' ' ' ILE . 81.2 mt -95.41 109.11 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.51 -0.743 . . . . 0.0 110.503 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.506 HG22 ' N ' ' A' ' 74' ' ' VAL . 79.4 m -96.14 157.0 16.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.219 -0.926 . . . . 0.0 110.451 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.54 ' HA ' ' O ' ' A' ' 6' ' ' HIS . 3.4 p -143.07 136.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.106 -0.996 . . . . 0.0 111.409 -179.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.427 ' C ' HG22 ' A' ' 76' ' ' THR . 0.4 OUTLIER -102.23 -179.53 4.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.294 0.568 . . . . 0.0 110.141 179.799 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.427 HG22 ' C ' ' A' ' 75' ' ' SER . 50.2 p -128.94 154.33 46.66 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.306 -0.871 . . . . 0.0 109.96 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -171.54 -170.33 35.46 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.414 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 56.2 m-85 -147.53 150.63 34.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.355 -1.085 . . . . 0.0 110.32 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.472 ' HE3' HD12 ' B' ' 4' ' ' ILE . 1.1 ttt -124.61 167.61 14.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.235 -0.915 . . . . 0.0 109.989 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 27.4 t -131.47 103.68 6.56 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.0 110.309 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 81' ' ' ILE . 6.5 tt . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.257 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 mtp . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.247 0.546 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' THR . . . . . 0.476 ' O ' HG21 ' B' ' 2' ' ' THR . 5.4 t -101.31 104.46 33.47 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 110.401 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.5 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -50.16 157.63 2.86 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 123.974 1.513 . . . . 0.0 110.114 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.472 HD12 ' HE3' ' A' ' 79' ' ' MET . 2.3 pp -143.87 119.05 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.217 -0.927 . . . . 0.0 110.325 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.409 HG12 HG21 ' B' ' 74' ' ' VAL . 1.1 t -94.11 136.11 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.262 -0.899 . . . . 0.0 110.301 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.519 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.2 138.57 41.19 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.29 -0.881 . . . . 0.0 109.666 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.468 ' HG ' ' CG2' ' B' ' 72' ' ' ILE . 0.3 OUTLIER -129.77 131.4 46.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.004 -1.06 . . . . 0.0 110.607 -179.484 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 15.0 ttpp -141.43 167.17 22.8 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.983 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.43 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 145.66 -151.53 23.72 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . 0.402 ' O ' ' HB ' ' B' ' 13' ' ' THR . 9.6 m-20 -64.93 127.25 30.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.275 -1.132 . . . . 0.0 110.655 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.34 -68.99 0.13 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.275 -0.89 . . . . 0.0 110.282 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . 0.411 ' OD1' ' N ' ' B' ' 13' ' ' THR . 10.3 p30 -45.71 -43.93 13.2 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.48 ' O ' HD12 ' B' ' 17' ' ' LEU . 22.2 m -57.83 -18.02 19.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.289 -0.882 . . . . 0.0 110.096 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.491 ' HA ' ' CD1' ' B' ' 17' ' ' LEU . 18.6 mt -91.74 -29.63 16.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.254 -0.904 . . . . 0.0 110.337 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.5 mmtt -59.17 -41.17 87.8 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.331 -0.856 . . . . 0.0 110.519 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 15.8 t -69.96 -36.56 75.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.368 -0.832 . . . . 0.0 110.564 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.491 ' CD1' ' HA ' ' B' ' 14' ' ' LEU . 44.4 mt -59.04 -54.12 50.68 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.115 -0.991 . . . . 0.0 110.495 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -46.08 -31.99 2.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.838 . . . . 0.0 110.332 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.89 -29.85 70.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.161 -0.962 . . . . 0.0 110.081 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -69.6 -21.95 63.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.262 -0.899 . . . . 0.0 110.008 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.432 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 10.2 m-30 -66.48 -36.3 82.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.87 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -63.71 -34.0 76.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.377 -0.827 . . . . 0.0 110.222 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -74.88 -9.3 58.41 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.161 -0.962 . . . . 0.0 109.753 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -145.16 43.66 1.32 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.379 -0.826 . . . . 0.0 109.948 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.454 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.8 t -57.73 -8.9 1.02 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.341 -0.849 . . . . 0.0 111.136 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 68.9 p -95.38 7.62 45.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.959 -1.088 . . . . 0.0 110.327 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.482 ' O ' ' NE2' ' B' ' 58' ' ' GLN . 5.0 mt -92.41 -54.49 3.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.878 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 31.6 p90 -93.7 169.46 10.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.273 -0.892 . . . . 0.0 109.779 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 5.5 m -100.53 -33.15 10.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.116 -0.99 . . . . 0.0 110.815 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.44 114.55 2.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.1 -1.0 . . . . 0.0 110.843 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.403 HG12 ' CD2' ' B' ' 51' ' ' LEU . 17.0 m -90.6 111.63 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.405 -0.809 . . . . 0.0 110.119 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.587 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -67.6 148.33 51.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.11 -0.994 . . . . 0.0 110.502 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' SER . . . . . 0.467 ' HB3' ' O ' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -61.6 158.96 14.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.344 -0.847 . . . . 0.0 110.245 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.409 ' HA ' HG21 ' B' ' 49' ' ' VAL . 86.1 m -68.18 134.9 51.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.317 -0.864 . . . . 0.0 110.602 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.567 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 59.5 p-90 -146.75 -178.17 6.04 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 109.549 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.583 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 70.4 t60 -162.35 174.44 12.79 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.828 -1.17 . . . . 0.0 110.685 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.583 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 73.5 m95 -78.54 103.57 8.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.183 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.268 -0.895 . . . . 0.0 110.167 -179.98 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.489 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.444 0.64 . . . . 0.0 110.44 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.537 ' N ' ' O ' ' B' ' 35' ' ' TRP . 44.5 mt -143.93 148.22 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 0.0 110.024 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . 0.409 HG21 ' HA ' ' B' ' 34' ' ' THR . 0.4 OUTLIER -127.47 -179.33 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.134 -0.979 . . . . 0.0 110.193 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.502 HG23 ' N ' ' B' ' 51' ' ' LEU . 93.4 m -145.73 154.27 41.87 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.502 ' N ' HG23 ' B' ' 50' ' ' THR . 18.9 mt -133.14 123.53 25.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.052 -1.03 . . . . 0.0 110.207 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.12 133.69 41.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 110.201 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.5 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 44.2 m-85 -118.91 154.41 33.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.275 -0.891 . . . . 0.0 110.226 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.09 -10.66 56.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 0.0 110.522 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -162.16 160.71 27.51 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.08 -1.012 . . . . 0.0 110.434 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 78.5 mt-10 -70.72 -38.81 73.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.238 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -53.63 -52.18 60.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 110.229 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.482 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 21.9 tt0 -58.25 -35.93 72.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.602 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.408 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 13.2 ttp85 -59.19 -54.33 48.21 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.054 -1.028 . . . . 0.0 110.68 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -61.0 -26.1 67.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 110.295 -179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.463 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 45.3 mt-30 -65.54 -54.89 21.64 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.22 -0.925 . . . . 0.0 109.915 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.563 ' CE1' ' CG2' ' B' ' 66' ' ' VAL . 1.7 t80 -55.67 -39.95 71.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.833 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 9.0 mt -59.19 -23.61 62.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.3 -0.875 . . . . 0.0 110.044 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.22 -18.95 21.18 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.217 -0.927 . . . . 0.0 110.362 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -94.43 -8.34 38.88 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.209 -0.932 . . . . 0.0 110.042 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.563 ' CG2' ' CE1' ' B' ' 62' ' ' PHE . 33.6 m -136.7 132.79 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.362 -0.836 . . . . 0.0 109.676 179.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 103.05 11.19 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.346 -0.846 . . . . 0.0 109.793 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.545 ' CG2' ' HD2' ' B' ' 69' ' ' PRO . 18.2 mt -87.98 130.67 45.61 Favored Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.297 -0.877 . . . . 0.0 110.215 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.545 ' HD2' ' CG2' ' B' ' 68' ' ' ILE . 40.7 Cg_endo -40.56 163.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 O-C-N 123.889 1.468 . . . . 0.0 110.501 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -75.47 3.03 10.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.334 -0.854 . . . . 0.0 111.008 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.56 -24.83 29.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.052 -1.03 . . . . 0.0 109.902 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.523 HD13 ' CG2' ' B' ' 68' ' ' ILE . 84.4 mt -95.55 108.6 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 110.417 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' THR . . . . . 0.516 HG22 ' N ' ' B' ' 74' ' ' VAL . 89.9 m -95.83 157.31 15.95 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.41 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.519 ' HA ' ' O ' ' B' ' 6' ' ' HIS . 3.2 p -143.29 137.37 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 111.539 -179.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' SER . . . . . 0.426 ' C ' HG22 ' B' ' 76' ' ' THR . 0.4 OUTLIER -103.22 -179.4 3.94 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.343 0.592 . . . . 0.0 110.167 179.588 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' THR . . . . . 0.426 HG22 ' C ' ' B' ' 75' ' ' SER . 46.5 p -128.83 154.37 46.51 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 109.929 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . 0.419 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -171.72 -170.16 35.39 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.419 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 57.7 m-85 -147.58 151.25 35.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.33 -1.1 . . . . 0.0 110.284 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.425 ' HE3' HD12 ' A' ' 4' ' ' ILE . 1.0 OUTLIER -125.16 167.14 15.23 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 0.0 109.982 179.774 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 27.3 t -131.06 103.95 6.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.097 -1.002 . . . . 0.0 110.284 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.462 ' O ' HG12 ' B' ' 81' ' ' ILE . 6.7 tt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.232 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mtp . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.518 ' O ' ' CG2' ' A' ' 2' ' ' THR . 15.1 t -92.0 113.78 60.04 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.978 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.505 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -62.55 160.33 32.54 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.894 1.47 . . . . 0.0 110.281 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.472 HG21 ' O ' ' A' ' 3' ' ' PRO . 1.0 OUTLIER -143.29 122.37 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.372 -0.83 . . . . 0.0 109.939 179.736 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.551 ' CG1' HG21 ' A' ' 74' ' ' VAL . 85.5 t -94.28 130.08 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.2 -0.937 . . . . 0.0 110.616 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.507 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.83 122.22 45.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.245 -0.909 . . . . 0.0 109.729 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.526 ' HG ' ' CG2' ' A' ' 72' ' ' ILE . 0.7 OUTLIER -115.67 135.97 53.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 0.0 110.792 -179.35 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 4.3 ttpp -140.65 166.18 25.44 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.216 -0.928 . . . . 0.0 109.834 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.46 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 150.9 -156.14 26.52 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -64.97 130.66 44.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.344 -1.092 . . . . 0.0 110.666 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.516 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.54 -63.1 1.23 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.301 -0.874 . . . . 0.0 110.551 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -44.87 -47.29 11.14 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 0.0 110.58 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.445 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 97.0 m -57.77 -30.52 65.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.16 -0.963 . . . . 0.0 110.545 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 6.8 mt -70.59 -33.51 71.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.17 -0.956 . . . . 0.0 110.263 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.51 -44.14 93.22 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.237 -0.914 . . . . 0.0 110.753 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.441 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 21.5 t -69.82 -38.24 76.51 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.246 -0.909 . . . . 0.0 110.856 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.446 HD11 ' HA ' ' A' ' 14' ' ' LEU . 21.6 mt -58.81 -56.19 25.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.561 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -45.95 -28.22 1.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.0 110.29 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 61.0 t80 -64.82 -31.12 72.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.176 -0.953 . . . . 0.0 109.903 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -67.61 -21.77 65.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.317 -0.864 . . . . 0.0 110.07 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.468 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.2 m-30 -66.25 -36.43 82.99 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.026 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -63.52 -41.0 98.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.277 -0.889 . . . . 0.0 110.031 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.06 -2.09 25.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.188 -0.945 . . . . 0.0 109.847 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -144.69 35.48 1.16 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.412 -0.805 . . . . 0.0 109.351 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.513 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.6 t -57.55 -9.41 1.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.576 -0.702 . . . . 0.0 111.054 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.4 p -95.51 4.9 52.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.986 -1.071 . . . . 0.0 110.411 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.441 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 8.8 mt -92.59 -48.78 6.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.161 -0.962 . . . . 0.0 110.171 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.513 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 10.2 p90 -100.67 165.78 11.22 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.974 . . . . 0.0 109.755 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 m -101.33 -30.32 11.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.93 -1.106 . . . . 0.0 110.887 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.3 111.38 2.13 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.048 -1.033 . . . . 0.0 110.899 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.438 HG11 ' CD1' ' A' ' 28' ' ' TYR . 31.9 m -90.58 140.63 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.27 -0.894 . . . . 0.0 110.02 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.597 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.0 OUTLIER -90.89 145.56 24.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 162.12 8.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.247 -0.908 . . . . 0.0 110.43 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.5 m -68.32 132.5 47.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.276 -0.89 . . . . 0.0 110.475 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.619 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 55.5 p-90 -146.81 -178.33 6.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 109.826 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.638 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 25.6 t60 -162.35 174.43 12.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.001 -1.062 . . . . 0.0 110.719 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.638 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 34.4 m95 -78.57 98.28 6.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.519 -0.738 . . . . 0.0 110.024 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.41 ' O ' HG22 ' B' ' 31' ' ' VAL . 32.8 p . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 110.225 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.488 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.416 0.627 . . . . 0.0 110.415 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.529 ' N ' ' O ' ' A' ' 35' ' ' TRP . 19.6 mt -143.95 167.81 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 110.032 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -147.16 -179.75 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.055 -1.028 . . . . 0.0 110.294 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.448 ' O ' ' OG ' ' A' ' 32' ' ' SER . 87.5 m -146.55 156.66 43.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.88 . . . . 0.0 109.945 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.449 HD22 ' CE2' ' A' ' 21' ' ' PHE . 1.5 mt -134.77 125.19 26.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.071 -1.018 . . . . 0.0 110.061 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 134.58 40.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.29 -0.882 . . . . 0.0 110.456 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.505 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 47.1 m-85 -120.25 154.83 34.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.232 -0.917 . . . . 0.0 110.308 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -86.4 -10.06 55.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 110.572 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.72 150.53 17.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.135 -0.978 . . . . 0.0 110.404 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.412 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 24.7 mt-10 -64.08 -39.08 93.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.898 . . . . 0.0 109.992 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.471 ' CD1' ' NE2' ' A' ' 61' ' ' GLN . 61.8 t-105 -53.57 -52.13 60.72 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.301 -0.874 . . . . 0.0 109.881 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.441 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 13.8 tt0 -57.37 -35.45 69.98 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.383 -0.823 . . . . 0.0 110.483 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.412 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 21.5 ttp85 -59.63 -50.45 73.81 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.083 -1.011 . . . . 0.0 110.966 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -60.93 -33.09 72.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.177 -0.952 . . . . 0.0 110.796 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.471 ' NE2' ' CD1' ' A' ' 57' ' ' TRP . 52.5 mt-30 -65.62 -47.34 75.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.158 -0.964 . . . . 0.0 110.207 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.461 ' C ' ' CD1' ' A' ' 62' ' ' PHE . 1.0 OUTLIER -55.69 -44.0 76.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 110.033 179.714 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.6 mt -59.22 -35.62 73.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.282 -0.886 . . . . 0.0 110.491 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.7 t -77.72 -18.9 56.07 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.147 -0.971 . . . . 0.0 110.449 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.478 ' O ' HG13 ' A' ' 66' ' ' VAL . 7.4 mm-40 -94.63 -9.44 35.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.621 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.478 HG13 ' O ' ' A' ' 65' ' ' GLN . 27.5 m -141.91 92.92 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.042 -1.036 . . . . 0.0 110.545 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -76.18 113.16 13.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.17 -0.956 . . . . 0.0 109.933 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.564 ' CG2' ' HD2' ' A' ' 69' ' ' PRO . 0.0 OUTLIER -89.76 162.94 34.5 Favored Pre-proline 0 N--CA 1.498 1.939 0 O-C-N 121.096 -1.003 . . . . 0.0 109.765 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.564 ' HD2' ' CG2' ' A' ' 68' ' ' ILE . 46.7 Cg_endo -60.93 -178.9 0.25 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.893 1.47 . . . . 0.0 110.133 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -91.97 -6.15 51.79 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 110.44 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.0 m -84.58 -20.35 31.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.0 110.022 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.526 ' CG2' ' HG ' ' A' ' 7' ' ' LEU . 33.0 mt -94.38 107.18 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.276 -0.89 . . . . 0.0 110.204 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -95.44 157.38 15.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 111.055 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.551 HG21 ' CG1' ' A' ' 5' ' ' VAL . 8.8 p -142.2 130.66 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.938 0.875 . . . . 0.0 111.24 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.75 172.79 6.64 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.311 0.577 . . . . 0.0 110.474 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.9 p -111.54 144.33 40.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.393 -0.817 . . . . 0.0 109.975 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -154.61 176.22 32.45 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -147.72 146.75 29.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.316 -1.108 . . . . 0.0 110.139 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 25.2 mtt -120.22 176.97 5.19 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.097 -1.002 . . . . 0.0 110.324 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.9 t -139.67 107.33 5.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.315 -0.866 . . . . 0.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.309 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mtp . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.217 0.532 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' THR . . . . . 0.516 ' CG2' ' O ' ' B' ' 2' ' ' THR . 15.2 t -92.21 113.82 60.35 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.23 -0.919 . . . . 0.0 109.94 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.504 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -62.4 160.15 32.72 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 123.999 1.526 . . . . 0.0 110.333 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.468 HG21 ' O ' ' B' ' 3' ' ' PRO . 1.0 OUTLIER -143.31 122.02 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.251 -0.906 . . . . 0.0 109.896 179.768 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.543 ' CG1' HG21 ' B' ' 74' ' ' VAL . 85.0 t -94.13 130.02 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.676 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.503 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.0 OUTLIER -105.5 122.97 47.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.279 -0.888 . . . . 0.0 109.565 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.54 ' HG ' ' CG2' ' B' ' 72' ' ' ILE . 0.7 OUTLIER -116.28 135.65 53.7 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.174 -0.954 . . . . 0.0 110.777 -179.427 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.48 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 4.4 ttpp -140.66 165.42 27.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 109.959 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.442 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 151.58 -155.78 26.33 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -65.0 130.96 45.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -1.117 . . . . 0.0 110.644 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.507 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.75 -62.66 1.47 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.393 -0.817 . . . . 0.0 110.613 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -45.64 -46.61 14.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 0.0 110.673 -179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.447 HG23 HD12 ' B' ' 17' ' ' LEU . 97.1 m -58.09 -30.6 66.37 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.226 -0.921 . . . . 0.0 110.493 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 6.8 mt -70.83 -32.93 70.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 110.259 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.34 -44.44 92.64 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.295 -0.878 . . . . 0.0 110.651 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.434 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 16.4 t -70.14 -38.11 75.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.28 -0.888 . . . . 0.0 111.151 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.47 HD11 ' HA ' ' B' ' 14' ' ' LEU . 21.6 mt -58.65 -55.66 32.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.067 -1.02 . . . . 0.0 110.334 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -45.96 -29.05 1.29 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.264 -0.897 . . . . 0.0 110.251 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.434 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 60.0 t80 -64.76 -29.5 70.48 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.968 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -68.95 -21.58 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.32 -0.863 . . . . 0.0 110.015 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.482 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.5 m-30 -66.41 -36.94 84.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.897 . . . . 0.0 110.051 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -63.38 -40.83 98.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -75.05 -1.78 24.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.189 -0.944 . . . . 0.0 109.659 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -144.86 35.19 1.13 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.443 -0.786 . . . . 0.0 109.421 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.518 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.7 t -57.61 -8.7 0.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.437 -0.789 . . . . 0.0 111.045 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 66.7 p -95.78 4.54 52.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.011 -1.056 . . . . 0.0 110.392 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 8.7 mt -92.32 -49.81 5.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 0.0 110.053 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.518 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 10.4 p90 -99.45 165.71 11.52 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 8.7 m -101.46 -30.96 11.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.037 -1.04 . . . . 0.0 110.969 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.37 111.63 2.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.072 -1.018 . . . . 0.0 110.71 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.442 HG11 ' CD1' ' B' ' 28' ' ' TYR . 32.9 m -90.59 143.35 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 110.127 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.619 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -92.09 144.99 24.87 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.15 -0.969 . . . . 0.0 110.459 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 161.7 9.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.381 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 15.7 m -68.09 132.14 46.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.279 -0.888 . . . . 0.0 110.508 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.597 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 56.1 p-90 -146.76 -177.97 5.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.876 . . . . 0.0 109.774 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.637 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 25.0 t60 -162.38 174.48 12.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.951 -1.093 . . . . 0.0 110.548 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.637 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 39.3 m95 -78.37 100.06 6.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.402 -0.811 . . . . 0.0 109.763 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.815 . . . . 0.0 110.314 -179.667 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.489 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.39 0.614 . . . . 0.0 110.399 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.489 HG13 ' C ' ' B' ' 47' ' ' ALA . 20.0 mt -143.96 168.21 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.398 -0.814 . . . . 0.0 110.102 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -147.46 -179.8 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.11 -0.993 . . . . 0.0 110.254 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.456 ' O ' ' OG ' ' B' ' 32' ' ' SER . 89.9 m -146.41 156.76 43.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.0 109.852 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.466 HD22 ' CE2' ' B' ' 21' ' ' PHE . 1.6 mt -134.62 125.33 26.96 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.983 -1.073 . . . . 0.0 110.123 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.87 134.31 41.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.283 -0.886 . . . . 0.0 110.482 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.504 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 47.3 m-85 -120.29 155.01 34.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.289 -0.882 . . . . 0.0 110.243 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -86.39 -10.67 53.87 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.235 -0.916 . . . . 0.0 110.521 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.07 150.25 18.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 0.0 110.567 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.406 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 25.9 mt-10 -63.62 -39.14 93.62 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.254 -0.904 . . . . 0.0 109.938 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . 0.476 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 62.2 t-105 -53.6 -52.18 60.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.226 -0.922 . . . . 0.0 109.851 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -57.3 -35.64 70.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.38 -0.825 . . . . 0.0 110.621 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.406 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 22.1 ttp85 -59.68 -50.02 75.49 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.088 -1.008 . . . . 0.0 110.956 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -60.97 -33.36 73.09 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.249 -0.907 . . . . 0.0 110.817 -179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.476 ' NE2' ' CD1' ' B' ' 57' ' ' TRP . 53.3 mt-30 -65.64 -47.32 75.98 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.085 -1.01 . . . . 0.0 110.368 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.471 ' C ' ' CD1' ' B' ' 62' ' ' PHE . 0.8 OUTLIER -55.67 -43.89 76.76 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 109.971 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 87.0 mt -59.28 -35.56 73.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.298 -0.877 . . . . 0.0 110.474 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.8 t -77.83 -18.65 56.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.24 -0.912 . . . . 0.0 110.315 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . 0.463 ' O ' HG13 ' B' ' 66' ' ' VAL . 7.6 mm-40 -94.65 -9.81 33.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.115 -0.99 . . . . 0.0 110.566 -179.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.463 HG13 ' O ' ' B' ' 65' ' ' GLN . 27.6 m -141.89 93.28 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 120.962 -1.086 . . . . 0.0 110.565 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . 0.511 ' O ' ' HG3' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -76.33 113.13 13.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.228 -0.92 . . . . 0.0 110.081 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.577 ' CG2' ' HD2' ' B' ' 69' ' ' PRO . 0.0 OUTLIER -89.56 162.63 35.92 Favored Pre-proline 0 N--CA 1.497 1.891 0 O-C-N 121.153 -0.967 . . . . 0.0 109.611 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.577 ' HD2' ' CG2' ' B' ' 68' ' ' ILE . 46.2 Cg_endo -60.64 -177.25 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.841 1.443 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -93.51 -5.56 48.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.17 -0.956 . . . . 0.0 110.368 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 88.0 m -84.59 -20.38 31.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.193 -0.942 . . . . 0.0 110.002 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.54 ' CG2' ' HG ' ' B' ' 7' ' ' LEU . 36.6 mt -94.67 107.46 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.333 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 88.9 m -95.33 157.28 15.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.394 -0.816 . . . . 0.0 110.881 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.543 HG21 ' CG1' ' B' ' 5' ' ' VAL . 8.2 p -141.96 130.51 22.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 CA-C-O 121.948 0.88 . . . . 0.0 111.188 -178.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.78 171.42 7.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.352 0.596 . . . . 0.0 110.554 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 33.4 p -110.29 145.37 37.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.322 -0.862 . . . . 0.0 109.848 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -156.12 176.48 33.55 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -147.87 147.62 29.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.241 -1.152 . . . . 0.0 110.179 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 24.4 mtt -120.91 177.81 4.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.298 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.9 t -140.51 107.15 5.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.917 . . . . 0.0 110.358 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.198 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.247 0.546 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.34 150.89 77.74 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.506 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 46.4 Cg_endo -100.99 145.78 0.31 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.886 1.466 . . . . 0.0 110.313 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.78 167.68 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 110.145 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.1 t -145.91 130.29 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.201 -0.937 . . . . 0.0 110.413 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.526 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.8 m170 -105.98 125.16 50.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 109.959 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.434 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.9 pp -121.92 146.77 46.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.084 -1.01 . . . . 0.0 110.478 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 12.4 ttmm -139.35 161.96 36.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.22 -0.925 . . . . 0.0 110.483 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.45 -165.93 38.13 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -65.05 140.37 58.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -1.217 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.42 -49.81 53.76 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 110.498 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -64.54 -43.53 93.7 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.279 -0.888 . . . . 0.0 110.845 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.7 m -57.81 -24.84 59.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.127 -0.983 . . . . 0.0 110.433 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.422 HD21 HD13 ' A' ' 7' ' ' LEU . 46.6 mt -79.75 -30.94 40.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.885 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -59.49 -41.82 90.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.478 -0.764 . . . . 0.0 110.558 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.53 -37.13 76.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.301 -0.874 . . . . 0.0 110.603 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.9 mt -59.07 -52.36 66.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.154 -0.967 . . . . 0.0 110.613 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -45.24 -31.39 1.5 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.679 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -64.82 -40.69 95.59 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.246 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -66.91 -35.92 81.08 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.1 m-30 -66.45 -35.38 80.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 110.32 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -63.43 -40.57 97.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.411 ' HA ' ' HD2' ' A' ' 23' ' ' LYS . 3.6 tptt -75.01 -37.85 61.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.0 110.318 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.632 ' O ' ' N ' ' A' ' 26' ' ' THR . 90.7 m-70 -95.44 33.75 1.55 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.163 -0.961 . . . . 0.0 110.443 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.564 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 32.0 p -59.36 53.36 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.489 -0.757 . . . . 0.0 111.275 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.632 ' N ' ' O ' ' A' ' 24' ' ' HIS . 14.8 p -144.42 34.63 1.18 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.936 -1.102 . . . . 0.0 109.853 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.43 HD23 ' CG ' ' A' ' 58' ' ' GLN . 10.4 mt -146.77 -21.69 0.42 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.194 -0.941 . . . . 0.0 111.382 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.62 ' CE2' ' CG2' ' A' ' 31' ' ' VAL . 39.8 p90 -115.42 166.64 11.66 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.442 -1.411 . . . . 0.0 109.56 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.85 -32.33 10.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.923 -1.111 . . . . 0.0 111.514 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.435 ' HB2' ' CE3' ' B' ' 37' ' ' TRP . . . -159.45 117.7 2.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.801 -1.187 . . . . 0.0 111.111 -179.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.62 ' CG2' ' CE2' ' A' ' 28' ' ' TYR . 5.1 t -89.84 102.16 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 110.025 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.578 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 5.0 p -69.39 147.05 51.54 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.482 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.35 161.1 9.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 110.226 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.401 ' HA ' HG22 ' A' ' 49' ' ' VAL . 3.0 t -68.28 140.79 55.99 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.383 -0.823 . . . . 0.0 110.753 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 63.2 p-90 -146.95 -176.1 5.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.405 -0.809 . . . . 0.0 109.418 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -162.57 174.32 12.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.89 -1.131 . . . . 0.0 111.047 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.503 ' CE3' ' HB2' ' B' ' 30' ' ' ALA . 57.7 m95 -79.13 118.46 21.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.538 -0.726 . . . . 0.0 110.09 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.0 m . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.334 -0.854 . . . . 0.0 110.306 -179.796 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.293 0.568 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' TRP . 16.8 mt -142.74 141.85 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.297 -0.877 . . . . 0.0 109.958 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.407 HG13 ' O ' ' A' ' 32' ' ' SER . 91.7 t -124.37 122.75 64.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.083 -1.011 . . . . 0.0 110.427 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.5 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 20.7 m -94.37 157.32 16.08 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.289 -0.882 . . . . 0.0 110.116 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.2 mt -135.32 130.98 35.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.254 -0.904 . . . . 0.0 110.198 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 63.4 p -96.76 127.29 42.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.237 -0.914 . . . . 0.0 110.464 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.556 ' OH ' ' CE2' ' A' ' 62' ' ' PHE . 27.4 m-85 -103.78 146.39 28.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 110.026 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 -9.68 55.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.175 -0.953 . . . . 0.0 110.769 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.9 p -162.62 134.98 5.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.068 -1.02 . . . . 0.0 110.591 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.93 -40.16 60.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.292 -0.88 . . . . 0.0 109.848 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 4.7 t-105 -53.55 -55.27 27.04 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.441 -0.787 . . . . 0.0 109.995 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' A' ' 61' ' ' GLN . 16.3 tt0 -57.03 -35.37 69.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.332 -0.855 . . . . 0.0 110.39 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.465 ' O ' ' HB3' ' A' ' 62' ' ' PHE . 7.3 ttp85 -59.52 -33.48 71.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.096 -1.003 . . . . 0.0 109.992 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.45 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -61.53 -60.8 3.14 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.359 -0.838 . . . . 0.0 111.305 -179.501 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.524 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 4.1 pm0 -65.14 -18.85 65.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.006 -1.059 . . . . 0.0 110.758 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.556 ' CE2' ' OH ' ' A' ' 53' ' ' TYR . 38.4 t80 -57.25 -65.01 0.7 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.009 -1.057 . . . . 0.0 110.401 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.467 ' HA ' HG23 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -59.51 -39.86 85.2 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.478 -0.764 . . . . 0.0 111.312 -179.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.51 -22.03 66.68 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.907 -1.121 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.524 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 15.6 mm-40 -95.37 -30.54 13.86 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.344 -0.848 . . . . 0.0 109.967 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.544 ' CG2' ' O ' ' A' ' 66' ' ' VAL . 15.1 m -97.91 85.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.302 -0.874 . . . . 0.0 109.72 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.47 ' C ' ' O ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -38.44 105.77 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.342 -0.849 . . . . 0.0 110.441 -179.639 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.499 ' O ' ' CG2' ' A' ' 68' ' ' ILE . 10.9 tt -89.53 126.67 57.4 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.532 -0.73 . . . . 0.0 110.17 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.08 -177.81 1.48 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.926 1.487 . . . . 0.0 110.396 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -86.64 -12.79 47.47 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.216 -0.928 . . . . 0.0 110.226 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.74 -11.21 56.28 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 110.165 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 9.8 mm -94.37 121.33 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.16 -0.962 . . . . 0.0 109.96 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.3 m -95.23 136.09 36.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.05 -1.031 . . . . 0.0 109.818 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.2 t -88.75 156.97 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.055 -1.028 . . . . 0.0 110.871 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.526 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 1.2 m -142.73 154.83 44.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.833 -0.542 . . . . 0.0 110.341 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.412 ' O ' HD12 ' B' ' 81' ' ' ILE . 21.1 p -133.0 134.98 45.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.075 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.6 -175.57 30.71 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -148.1 152.78 37.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.206 -1.173 . . . . 0.0 110.528 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -123.74 169.69 11.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.334 -0.854 . . . . 0.0 109.949 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.435 ' O ' HD12 ' A' ' 81' ' ' ILE . 9.6 t -150.22 99.65 2.82 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.244 -0.91 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.462 HD12 ' O ' ' B' ' 76' ' ' THR . 1.1 mp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.051 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.306 0.574 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.2 150.45 76.54 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.25 -0.906 . . . . 0.0 110.094 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.516 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.2 Cg_endo -100.19 145.59 0.38 Allowed 'Trans proline' 0 C--N 1.304 -1.791 0 O-C-N 123.94 1.494 . . . . 0.0 110.187 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.72 168.09 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.02 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -146.12 130.35 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.93 . . . . 0.0 110.426 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.569 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.7 m170 -106.09 125.64 51.23 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.297 -0.877 . . . . 0.0 109.782 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.448 HD13 HD21 ' B' ' 14' ' ' LEU . 1.9 pp -122.76 147.26 46.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.987 -1.071 . . . . 0.0 110.536 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 12.4 ttmm -139.61 162.03 36.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.288 -0.882 . . . . 0.0 110.465 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.84 -166.38 38.57 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -64.93 140.18 58.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -1.172 . . . . 0.0 110.252 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.97 -49.56 49.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -65.0 -43.52 92.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.828 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 75.5 m -57.64 -24.28 55.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.184 -0.948 . . . . 0.0 110.504 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.448 HD21 HD13 ' B' ' 7' ' ' LEU . 41.7 mt -80.82 -30.64 35.78 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.155 -0.966 . . . . 0.0 109.918 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -59.42 -41.91 90.6 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.406 -0.808 . . . . 0.0 110.45 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -69.78 -37.27 76.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.369 -0.832 . . . . 0.0 110.605 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 mt -58.82 -51.55 69.54 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.033 -1.042 . . . . 0.0 110.297 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.5 ttp85 -45.49 -31.69 1.88 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.291 -0.88 . . . . 0.0 110.582 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -64.78 -40.6 95.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.109 -0.994 . . . . 0.0 110.239 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -67.15 -35.76 80.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.145 -0.972 . . . . 0.0 110.156 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.427 ' N ' ' CD1' ' B' ' 21' ' ' PHE . 10.1 m-30 -66.43 -35.11 79.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -63.51 -40.87 98.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.313 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . 0.408 ' HA ' ' HD2' ' B' ' 23' ' ' LYS . 3.6 tptt -75.02 -38.03 61.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.165 -0.96 . . . . 0.0 110.452 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.633 ' O ' ' N ' ' B' ' 26' ' ' THR . 91.3 m-70 -95.25 33.8 1.51 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.202 -0.936 . . . . 0.0 110.348 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.584 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 32.0 p -59.34 53.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.536 -0.727 . . . . 0.0 111.318 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.633 ' N ' ' O ' ' B' ' 24' ' ' HIS . 9.3 p -144.38 34.73 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.908 -1.12 . . . . 0.0 109.822 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.426 ' O ' ' CD ' ' B' ' 58' ' ' GLN . 10.9 mt -146.9 -21.47 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.181 -0.949 . . . . 0.0 111.356 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.593 ' CE2' ' CG2' ' B' ' 31' ' ' VAL . 39.5 p90 -115.45 166.73 11.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.604 -1.31 . . . . 0.0 109.558 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -32.6 10.57 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.941 -1.099 . . . . 0.0 111.583 -179.13 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . 0.503 ' HB2' ' CE3' ' A' ' 37' ' ' TRP . . . -159.58 118.07 2.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.816 -1.177 . . . . 0.0 111.08 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.593 ' CG2' ' CE2' ' B' ' 28' ' ' TYR . 4.6 t -89.91 101.08 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.361 -0.837 . . . . 0.0 110.086 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.58 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 5.5 p -67.85 146.78 53.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.075 -1.016 . . . . 0.0 110.438 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.38 161.6 9.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.221 -0.925 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.451 ' HA ' HG22 ' B' ' 49' ' ' VAL . 3.5 t -68.27 140.38 55.99 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.3 -0.875 . . . . 0.0 110.628 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.578 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 62.8 p-90 -147.03 -176.43 5.21 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.369 -0.832 . . . . 0.0 109.542 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.6 p-80 -162.44 174.4 12.77 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.839 -1.163 . . . . 0.0 111.121 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.435 ' CE3' ' HB2' ' A' ' 30' ' ' ALA . 56.8 m95 -79.21 118.34 21.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.447 -0.783 . . . . 0.0 110.183 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 20.4 m . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.322 -0.861 . . . . 0.0 110.248 -179.928 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.307 0.575 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 35' ' ' TRP . 15.9 mt -142.61 142.05 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.415 -0.803 . . . . 0.0 109.996 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' B' ' 34' ' ' THR . 88.9 t -124.47 121.91 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.069 -1.019 . . . . 0.0 110.209 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.569 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 18.1 m -93.8 157.7 16.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.933 . . . . 0.0 109.953 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 1.2 mt -135.26 131.53 36.7 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.114 -0.991 . . . . 0.0 110.266 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.431 HG23 ' CH2' ' A' ' 37' ' ' TRP . 56.6 p -97.06 127.52 43.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.372 -0.83 . . . . 0.0 110.51 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.52 ' OH ' ' CE2' ' B' ' 62' ' ' PHE . 28.7 m-85 -104.32 146.43 28.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.892 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.63 -8.65 57.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 110.805 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 73.1 p -163.83 135.21 4.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.067 -1.02 . . . . 0.0 110.585 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.95 -40.27 60.59 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.86 . . . . 0.0 109.961 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -53.42 -54.99 28.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.333 -0.854 . . . . 0.0 109.894 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' B' ' 61' ' ' GLN . 17.4 tt0 -57.02 -36.0 69.93 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.386 -0.821 . . . . 0.0 110.455 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' B' ' 62' ' ' PHE . 6.4 ttp180 -59.54 -33.17 71.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.971 -1.081 . . . . 0.0 110.128 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' B' ' 63' ' ' LEU . 0.3 OUTLIER -61.48 -60.81 3.14 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.394 -0.816 . . . . 0.0 111.205 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.526 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 4.2 pm0 -65.17 -19.14 65.83 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.902 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.52 ' CE2' ' OH ' ' B' ' 53' ' ' TYR . 36.2 t80 -57.02 -65.35 0.63 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.055 -1.028 . . . . 0.0 110.36 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . 0.484 ' HA ' HG23 ' B' ' 66' ' ' VAL . 0.4 OUTLIER -59.36 -39.37 83.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.452 -0.78 . . . . 0.0 111.305 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.87 -21.82 66.49 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.859 -1.151 . . . . 0.0 110.292 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 15.4 mm-40 -95.42 -30.95 13.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.896 . . . . 0.0 109.985 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.536 ' CG2' ' O ' ' B' ' 66' ' ' VAL . 16.6 m -97.42 85.49 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 109.895 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . 0.466 ' C ' ' O ' ' B' ' 66' ' ' VAL . 0.1 OUTLIER -37.84 105.92 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.421 -0.8 . . . . 0.0 110.56 -179.711 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.496 ' CG2' ' O ' ' B' ' 68' ' ' ILE . 10.3 tt -89.89 126.7 56.62 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.359 -0.838 . . . . 0.0 110.182 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -67.93 -177.88 1.46 Allowed 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 124.018 1.536 . . . . 0.0 110.32 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -86.74 -12.85 47.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.248 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -11.58 55.42 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 110.216 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.427 ' HA ' ' O ' ' B' ' 8' ' ' LYS . 9.8 mm -94.3 121.41 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.217 -0.927 . . . . 0.0 109.898 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.0 m -95.41 136.35 35.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.018 -1.052 . . . . 0.0 109.937 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 11.1 t -88.55 156.92 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.029 -1.045 . . . . 0.0 111.074 -178.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' SER . . . . . 0.528 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 1.4 m -142.52 154.76 44.77 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.75 -0.594 . . . . 0.0 110.402 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' THR . . . . . 0.462 ' O ' HD12 ' A' ' 81' ' ' ILE . 21.0 p -133.1 134.68 44.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.175 -0.953 . . . . 0.0 110.103 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.51 -175.62 30.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -147.88 153.01 38.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.177 -1.19 . . . . 0.0 110.509 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -124.12 168.6 12.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.272 -0.892 . . . . 0.0 110.039 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.445 ' O ' HD12 ' B' ' 81' ' ' ILE . 9.2 t -149.08 99.87 3.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.145 -0.972 . . . . 0.0 110.417 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.445 HD12 ' O ' ' B' ' 80' ' ' SER . 1.1 mp . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 118.035 -0.984 . . . . 0.0 109.969 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.444 ' CG ' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.246 0.546 . . . . 0.0 110.152 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -146.39 170.89 7.13 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.212 -0.93 . . . . 0.0 110.303 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.502 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 51.9 Cg_endo -104.61 145.6 0.13 Allowed 'Trans proline' 0 C--N 1.307 -1.638 0 O-C-N 124.034 1.544 . . . . 0.0 110.308 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 3' ' ' PRO . 2.8 pt -143.82 162.63 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.212 -0.93 . . . . 0.0 110.041 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.521 ' CG2' HG23 ' A' ' 74' ' ' VAL . 9.6 p -145.78 127.47 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 0.0 110.074 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.593 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.1 m170 -104.13 118.32 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.348 -0.845 . . . . 0.0 110.135 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.423 ' CD2' ' O ' ' A' ' 49' ' ' VAL . 1.3 pp -111.54 150.91 29.31 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.127 -0.983 . . . . 0.0 110.222 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.527 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 7.6 tptm -138.71 159.27 42.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 110.482 -179.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.527 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 170.67 -174.56 44.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.474 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 40.2 m-20 -65.05 141.49 58.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.153 -1.204 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.497 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.33 -69.28 0.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.238 -0.914 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -47.78 -44.96 28.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.065 -1.022 . . . . 0.0 110.385 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.474 ' HB ' ' HB2' ' A' ' 10' ' ' ASP . 41.4 m -58.22 -22.81 53.55 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.257 -0.902 . . . . 0.0 110.61 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 62.8 mt -78.39 -29.79 47.46 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.179 -0.951 . . . . 0.0 110.532 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -59.71 -34.44 72.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.211 -0.931 . . . . 0.0 110.417 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.483 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.9 t -70.27 -46.13 64.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.358 -0.839 . . . . 0.0 110.943 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.8 mp -58.82 -52.76 64.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.057 -1.027 . . . . 0.0 110.59 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.411 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 10.5 ttm180 -45.04 -24.69 0.25 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.221 -0.924 . . . . 0.0 110.516 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.483 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 40.1 t80 -64.8 -40.46 95.26 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.078 -1.014 . . . . 0.0 110.234 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -72.88 -21.18 60.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 110.134 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.411 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 8.6 m-30 -66.26 -31.32 72.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 109.954 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -63.57 -33.98 76.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.338 -0.851 . . . . 0.0 110.336 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -75.08 -35.15 61.82 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.245 -0.909 . . . . 0.0 110.41 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 73.4 m-70 -94.48 40.93 1.09 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.243 -0.91 . . . . 0.0 110.12 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.443 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 27.3 p -57.65 -21.52 40.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.355 -0.841 . . . . 0.0 110.512 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.412 HG23 ' SG ' ' A' ' 25' ' ' CYS . 69.2 p -96.52 10.91 36.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.095 -1.003 . . . . 0.0 110.499 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.499 ' HB2' ' HB3' ' A' ' 24' ' ' HIS . 2.3 mt -92.26 -49.39 6.2 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 110.16 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.443 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 4.4 p90 -98.9 168.56 10.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.247 -0.908 . . . . 0.0 110.236 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.1 m -98.92 -31.35 11.87 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.848 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.08 116.09 2.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.011 -1.056 . . . . 0.0 110.608 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.2 p -90.2 135.06 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.883 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.486 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -108.37 154.25 22.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.083 -1.011 . . . . 0.0 110.689 -179.689 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.35 162.56 7.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.359 -0.838 . . . . 0.0 110.265 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.455 ' O ' HG21 ' A' ' 34' ' ' THR . 2.2 t -68.14 131.06 44.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.26 -0.9 . . . . 0.0 110.751 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.536 ' HB3' ' CB ' ' B' ' 35' ' ' TRP . 3.9 p-90 -146.93 157.51 43.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.353 -0.842 . . . . 0.0 109.405 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -162.58 -173.73 3.67 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.823 -1.173 . . . . 0.0 111.354 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.6 m95 -79.97 138.82 37.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.66 -0.65 . . . . 0.0 110.114 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 110.408 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.471 ' HB1' ' CD1' ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.322 0.582 . . . . 0.0 109.968 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.472 HG12 ' HB2' ' A' ' 8' ' ' LYS . 74.1 mt -145.03 133.76 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.326 -0.859 . . . . 0.0 110.123 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.423 ' O ' ' CD2' ' A' ' 7' ' ' LEU . 19.1 t -119.73 130.27 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.049 -1.032 . . . . 0.0 110.442 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.58 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 3.0 m -94.16 156.41 16.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.336 -0.853 . . . . 0.0 110.234 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.493 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 1.0 OUTLIER -135.01 129.98 34.97 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.245 -0.909 . . . . 0.0 109.637 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.11 130.94 44.32 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.217 -0.927 . . . . 0.0 110.675 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.502 ' O ' ' HG2' ' A' ' 3' ' ' PRO . 49.0 m-85 -118.48 155.79 30.21 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.383 -0.823 . . . . 0.0 109.956 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.69 -10.32 59.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 110.32 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.9 p -170.26 166.19 8.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.168 -0.958 . . . . 0.0 110.305 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.44 -34.96 73.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.344 -0.848 . . . . 0.0 110.171 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -53.79 -50.82 65.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.342 -0.848 . . . . 0.0 110.12 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -57.95 -38.04 75.25 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.251 -0.906 . . . . 0.0 110.855 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.18 -44.31 92.17 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.003 -1.06 . . . . 0.0 110.745 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -61.01 -38.58 86.6 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.104 -0.998 . . . . 0.0 110.518 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -65.92 -41.49 91.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.134 -0.979 . . . . 0.0 110.725 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.579 ' CE1' HG23 ' A' ' 66' ' ' VAL . 2.7 t80 -55.85 -47.4 77.35 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.5 mt -59.44 -44.66 92.9 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.256 -0.903 . . . . 0.0 110.459 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -21.45 66.54 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.254 -0.904 . . . . 0.0 110.63 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -95.44 -25.26 16.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.085 -1.01 . . . . 0.0 110.369 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.579 HG23 ' CE1' ' A' ' 62' ' ' PHE . 31.2 m -103.64 105.06 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.892 . . . . 0.0 110.036 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -51.4 97.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.192 -0.943 . . . . 0.0 110.395 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.566 ' O ' ' CG2' ' A' ' 68' ' ' ILE . 9.4 tp -88.66 117.5 68.39 Favored Pre-proline 0 N--CA 1.487 1.424 0 O-C-N 121.169 -0.957 . . . . 0.0 109.979 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.494 ' CG ' HD11 ' A' ' 72' ' ' ILE . 46.2 Cg_endo -60.58 167.97 7.45 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.916 1.482 . . . . 0.0 110.852 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -79.53 -12.98 59.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.45 -0.782 . . . . 0.0 110.315 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.61 -23.73 29.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.27 -0.894 . . . . 0.0 110.227 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.494 HD11 ' CG ' ' A' ' 69' ' ' PRO . 66.0 mt -93.68 115.27 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.913 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.3 m -95.09 142.48 27.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.323 -0.861 . . . . 0.0 110.727 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.521 HG23 ' CG2' ' A' ' 5' ' ' VAL . 6.0 p -92.25 178.49 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.421 -0.799 . . . . 0.0 110.582 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.593 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.6 OUTLIER -143.85 158.76 43.47 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.499 179.216 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.6 p -133.86 135.12 43.5 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.231 -0.918 . . . . 0.0 110.058 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -160.74 177.03 37.31 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.431 ' CD2' ' HB3' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.93 120.43 8.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.287 -1.125 . . . . 0.0 109.969 -179.802 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.452 ' SD ' HD13 ' B' ' 4' ' ' ILE . 18.3 mmm -95.13 171.74 8.55 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.051 -1.031 . . . . 0.0 110.576 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.3 p -153.67 107.81 3.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.33 -0.856 . . . . 0.0 110.305 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.6 pt . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.225 179.961 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.487 ' CG ' ' O ' ' B' ' 79' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.198 0.523 . . . . 0.0 110.11 . . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.5 t -146.13 171.96 5.84 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.262 -0.899 . . . . 0.0 110.103 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.486 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 51.1 Cg_endo -106.13 145.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.847 1.446 . . . . 0.0 110.054 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.465 HG22 ' O ' ' B' ' 3' ' ' PRO . 2.7 pt -143.83 162.79 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.253 -0.904 . . . . 0.0 110.04 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.504 ' CG2' HG23 ' B' ' 74' ' ' VAL . 8.6 p -145.67 127.84 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.336 -0.853 . . . . 0.0 110.08 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.595 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 1.5 m170 -104.66 118.19 35.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.355 -0.841 . . . . 0.0 110.148 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.441 HD21 ' O ' ' B' ' 49' ' ' VAL . 1.3 pp -111.35 150.93 29.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 110.219 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.53 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 7.7 tptm -138.56 159.53 41.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 110.381 -179.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.53 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 170.23 -174.55 44.3 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . 0.479 ' HB2' ' HB ' ' B' ' 13' ' ' THR . 40.6 m-20 -65.12 141.83 58.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.126 -1.22 . . . . 0.0 110.291 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.37 -69.4 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.315 -0.865 . . . . 0.0 110.524 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -47.54 -45.49 26.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.156 -0.965 . . . . 0.0 110.528 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.479 ' HB ' ' HB2' ' B' ' 10' ' ' ASP . 37.2 m -58.14 -22.09 49.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 110.723 -179.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.495 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 65.2 mt -78.83 -29.69 44.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.141 -0.975 . . . . 0.0 110.487 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -59.82 -34.4 73.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.213 -0.929 . . . . 0.0 110.319 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.485 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 1.6 t -70.31 -46.49 64.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.215 -0.928 . . . . 0.0 110.966 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.64 -52.81 64.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.066 -1.021 . . . . 0.0 110.536 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -45.09 -24.74 0.26 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 110.621 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.485 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 41.5 t80 -64.8 -39.7 94.02 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.216 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -73.41 -21.29 60.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.145 -0.972 . . . . 0.0 110.159 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -66.18 -31.43 72.26 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.228 -0.92 . . . . 0.0 109.897 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -63.49 -33.76 76.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.12 -35.16 61.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.175 -0.953 . . . . 0.0 110.436 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.49 ' HB3' ' HB2' ' B' ' 27' ' ' LEU . 76.0 m-70 -94.84 41.16 1.09 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.942 . . . . 0.0 110.169 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.451 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 27.5 p -57.32 -21.07 32.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.359 -0.838 . . . . 0.0 110.379 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.449 HG23 ' SG ' ' B' ' 25' ' ' CYS . 69.8 p -96.91 10.63 38.51 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.128 -0.982 . . . . 0.0 110.467 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.49 ' HB2' ' HB3' ' B' ' 24' ' ' HIS . 2.6 mt -92.23 -49.18 6.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.19 -0.944 . . . . 0.0 110.286 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.451 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 4.3 p90 -98.92 168.45 10.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.5 m -98.78 -31.12 12.04 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.25 -0.906 . . . . 0.0 110.68 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.29 116.44 2.7 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.011 -1.056 . . . . 0.0 110.594 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 11.2 p -90.27 135.14 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.304 -0.873 . . . . 0.0 109.663 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.477 ' CB ' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -108.2 154.66 21.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.114 -0.991 . . . . 0.0 110.615 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.39 162.44 7.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.43 -0.794 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.445 HG21 ' O ' ' B' ' 34' ' ' THR . 2.1 t -68.24 130.51 43.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.266 -0.896 . . . . 0.0 110.64 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.536 ' CB ' ' HB3' ' A' ' 35' ' ' TRP . 4.3 p-90 -146.83 157.33 43.63 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.287 -0.883 . . . . 0.0 109.368 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -162.45 -173.68 3.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.866 -1.146 . . . . 0.0 111.359 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -79.89 139.94 36.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.686 -0.634 . . . . 0.0 109.995 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.625 0 O-C-N 121.199 -0.938 . . . . 0.0 110.322 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.441 ' HB1' ' CD1' ' B' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.334 0.588 . . . . 0.0 110.176 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.479 HG12 ' HB2' ' B' ' 8' ' ' LYS . 74.7 mt -144.98 133.32 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 109.967 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . 0.441 ' O ' HD21 ' B' ' 7' ' ' LEU . 16.5 t -119.2 130.37 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.038 -1.039 . . . . 0.0 110.424 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.578 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 2.7 m -94.07 157.1 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.308 -0.87 . . . . 0.0 110.27 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.492 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 1.0 OUTLIER -135.51 129.84 33.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 179.614 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.13 131.01 44.31 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.154 -0.966 . . . . 0.0 110.711 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.486 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 44.0 m-85 -118.65 155.44 31.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 0.0 110.085 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -70.8 -10.1 58.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.156 -0.965 . . . . 0.0 110.488 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 40.7 p -170.1 166.17 9.13 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.209 -0.932 . . . . 0.0 110.269 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -70.59 -35.1 72.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.182 -0.948 . . . . 0.0 110.236 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.47 -51.04 64.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.403 -0.811 . . . . 0.0 110.224 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -58.02 -37.18 73.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 110.734 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.55 -44.71 93.18 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.085 -1.01 . . . . 0.0 110.631 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -60.94 -38.41 85.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.197 -0.94 . . . . 0.0 110.624 -179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -65.8 -41.44 91.93 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.268 -0.895 . . . . 0.0 110.747 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.572 ' CE1' HG23 ' B' ' 66' ' ' VAL . 2.3 t80 -55.96 -47.41 77.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.156 -0.965 . . . . 0.0 110.24 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 13.7 mt -59.48 -43.95 93.14 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.166 -0.959 . . . . 0.0 110.652 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -21.33 66.23 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.204 -0.935 . . . . 0.0 110.628 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.31 -25.27 16.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.157 -0.964 . . . . 0.0 110.296 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.572 HG23 ' CE1' ' B' ' 62' ' ' PHE . 32.4 m -103.78 104.81 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.3 -0.875 . . . . 0.0 109.952 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttt -51.34 97.59 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.319 -0.863 . . . . 0.0 110.379 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.563 ' CG2' ' O ' ' B' ' 68' ' ' ILE . 8.6 tp -88.43 117.77 68.73 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.259 -0.9 . . . . 0.0 109.932 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.526 ' CG ' HD11 ' B' ' 72' ' ' ILE . 48.7 Cg_endo -61.23 168.25 8.03 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.889 1.468 . . . . 0.0 110.594 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -79.98 -12.81 59.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.283 -0.886 . . . . 0.0 110.347 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.53 -23.08 29.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.224 -0.923 . . . . 0.0 110.09 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.526 HD11 ' CG ' ' B' ' 69' ' ' PRO . 67.5 mt -94.21 115.29 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.253 -0.905 . . . . 0.0 110.026 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 7.7 m -95.23 142.38 27.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.33 -0.856 . . . . 0.0 110.839 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.504 HG23 ' CG2' ' B' ' 5' ' ' VAL . 5.4 p -92.28 178.65 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.278 -0.889 . . . . 0.0 110.52 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' SER . . . . . 0.595 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -144.03 158.64 43.58 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.397 -0.814 . . . . 0.0 110.622 179.125 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.9 p -133.57 134.72 43.67 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 110.129 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.94 176.83 36.62 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.405 ' CD2' ' HB3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -148.06 119.94 8.16 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.316 -1.108 . . . . 0.0 109.82 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.487 ' O ' ' CG ' ' B' ' 1' ' ' MET . 19.1 mmm -94.52 173.08 7.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.971 -1.081 . . . . 0.0 110.472 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 85.9 p -154.85 107.16 2.73 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.222 -0.924 . . . . 0.0 110.272 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 4.8 pt . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 117.921 -1.038 . . . . 0.0 110.262 -179.972 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.205 0.526 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.5 m -68.61 121.65 81.77 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 121.263 -0.898 . . . . 0.0 110.122 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.498 ' O ' HG22 ' A' ' 4' ' ' ILE . 47.1 Cg_endo -69.11 157.17 62.68 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.08 1.568 . . . . 0.0 110.52 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 3' ' ' PRO . 5.1 pt -143.02 169.13 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.231 -0.918 . . . . 0.0 110.031 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.537 ' CG1' HG22 ' A' ' 74' ' ' VAL . 6.4 t -145.8 125.64 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.211 -0.931 . . . . 0.0 110.187 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.465 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -106.19 119.02 38.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.347 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.451 ' O ' HG21 ' A' ' 48' ' ' ILE . 1.4 mp -116.5 147.4 41.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.312 -0.867 . . . . 0.0 110.177 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.52 ' O ' ' CD1' ' A' ' 72' ' ' ILE . 11.5 tttt -142.42 168.5 19.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.214 -0.929 . . . . 0.0 110.388 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.432 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 151.76 -166.02 30.73 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.472 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 131.01 45.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.194 -1.18 . . . . 0.0 110.253 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.97 -39.8 41.98 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.28 -0.887 . . . . 0.0 110.726 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -66.08 -46.91 76.02 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.077 -1.015 . . . . 0.0 110.605 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.8 m -58.1 -27.77 64.0 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.938 . . . . 0.0 110.367 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.509 ' CD2' HD11 ' A' ' 72' ' ' ILE . 77.7 mt -77.71 -27.4 50.65 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.969 . . . . 0.0 110.34 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.2 ttmt -59.35 -39.39 83.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.252 -0.905 . . . . 0.0 110.411 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.2 t -70.19 -34.23 72.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.098 -1.001 . . . . 0.0 110.423 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.486 HD13 ' N ' ' A' ' 17' ' ' LEU . 5.9 mp -58.94 -51.91 68.01 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.212 -0.93 . . . . 0.0 110.558 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.495 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 1.2 ttp-105 -46.22 -31.86 2.7 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.264 -0.897 . . . . 0.0 110.124 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.473 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 48.4 t80 -65.14 -33.06 75.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.306 -0.871 . . . . 0.0 110.391 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 -74.74 -30.32 61.46 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.203 -0.936 . . . . 0.0 110.465 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.495 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 11.1 m-30 -66.32 -21.58 66.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -63.38 -36.53 84.02 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.615 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -75.1 -40.95 59.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -0.936 . . . . 0.0 110.463 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.411 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 15.0 m-70 -95.12 36.52 1.21 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.227 -0.921 . . . . 0.0 110.328 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.579 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 32.0 p -57.44 -17.92 15.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.474 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.95 -3.29 41.99 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.206 -0.934 . . . . 0.0 110.518 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.411 ' HB2' ' HB3' ' A' ' 24' ' ' HIS . 11.2 mt -92.42 -6.19 50.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.181 -0.949 . . . . 0.0 110.495 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.579 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 22.7 p90 -144.58 -178.08 5.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.194 -0.941 . . . . 0.0 109.528 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 45.6 m -96.47 -68.99 0.77 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.914 -1.116 . . . . 0.0 110.584 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.2 20.79 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.081 -1.012 . . . . 0.0 109.012 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.451 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 12.7 p -91.29 112.58 25.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 O-C-N 121.681 -0.637 . . . . 0.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.433 ' OG ' ' HB ' ' A' ' 50' ' ' THR . 79.5 p -52.59 152.62 3.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.926 -1.109 . . . . 0.0 109.373 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.404 ' OG ' ' HB2' ' B' ' 35' ' ' TRP . 0.8 OUTLIER -60.93 155.08 20.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.166 -0.959 . . . . 0.0 110.305 -179.651 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -67.64 129.78 40.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.333 -0.855 . . . . 0.0 110.318 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.472 ' HB2' ' OG ' ' B' ' 33' ' ' SER . 44.4 p-90 -146.15 176.15 9.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.189 -0.944 . . . . 0.0 109.921 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.471 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 53.2 t-80 -162.57 177.83 9.09 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 110.351 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.471 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 80.2 m95 -78.51 123.99 27.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.225 -0.922 . . . . 0.0 110.126 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.443 ' OG1' ' O ' ' A' ' 37' ' ' TRP . 1.8 m . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.37 -0.831 . . . . 0.0 109.916 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.472 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.233 0.539 . . . . 0.0 110.068 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.472 HG13 ' C ' ' A' ' 47' ' ' ALA . 70.3 mt -142.07 144.56 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 110.353 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.5 t -116.79 169.07 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.285 -0.884 . . . . 0.0 110.458 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.433 ' HB ' ' OG ' ' A' ' 32' ' ' SER . 17.4 m -146.05 152.16 38.89 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.369 -0.832 . . . . 0.0 109.891 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.42 128.78 32.17 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.169 -0.957 . . . . 0.0 110.249 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.47 ' OG1' ' CZ3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.61 40.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.361 -0.837 . . . . 0.0 110.158 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.577 ' CD2' ' HA ' ' A' ' 59' ' ' ARG . 40.2 m-85 -111.91 147.35 36.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.203 -0.936 . . . . 0.0 109.93 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -93.21 -3.28 54.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 110.941 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.1 p -157.66 121.04 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.028 -1.045 . . . . 0.0 110.328 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 2.3 mt-10 -46.32 -42.44 14.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.867 . . . . 0.0 110.132 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.413 ' CD1' ' NE2' ' A' ' 61' ' ' GLN . 16.0 t-105 -53.66 -56.0 21.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -59.07 -31.21 68.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.291 -0.881 . . . . 0.0 110.629 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.577 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -59.34 -54.55 45.43 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.273 -0.892 . . . . 0.0 111.061 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.0 -31.7 71.3 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.153 -0.967 . . . . 0.0 110.975 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.432 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 51.4 mt-30 -65.64 -46.48 79.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.115 -0.991 . . . . 0.0 110.761 -179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.477 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 38.4 t80 -56.46 -67.49 0.3 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 111.007 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.477 ' N ' ' CD2' ' A' ' 62' ' ' PHE . 4.2 pp -59.17 -12.98 5.93 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.227 -0.921 . . . . 0.0 110.98 -179.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 t -88.59 -23.41 23.12 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.036 -1.04 . . . . 0.0 109.97 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 3.6 mm100 -97.67 -44.34 6.81 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.461 -0.774 . . . . 0.0 109.829 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.428 ' CG1' ' O ' ' A' ' 62' ' ' PHE . 1.8 p -98.45 91.67 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 109.935 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.436 ' C ' HG12 ' A' ' 68' ' ' ILE . 19.1 pttp -65.29 -177.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.44 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.559 ' CG2' ' HD2' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -151.09 149.92 26.12 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.286 -0.884 . . . . 0.0 109.52 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.559 ' HD2' ' CG2' ' A' ' 68' ' ' ILE . 44.8 Cg_endo -49.7 -177.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.807 1.425 . . . . 0.0 110.455 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.74 -3.42 42.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.294 -0.879 . . . . 0.0 110.683 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -23.15 29.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.096 -1.002 . . . . 0.0 109.934 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.52 ' CD1' ' O ' ' A' ' 8' ' ' LYS . 2.2 tp -94.58 106.34 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.393 -0.817 . . . . 0.0 110.212 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.409 HG21 ' N ' ' A' ' 74' ' ' VAL . 28.5 m -97.34 156.37 16.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.049 -1.032 . . . . 0.0 109.483 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.537 HG22 ' CG1' ' A' ' 5' ' ' VAL . 5.8 p -143.85 138.1 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 118.883 -1.127 . . . . 0.0 111.774 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 -179.22 3.94 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.899 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.6 p -128.33 155.67 44.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.214 -0.929 . . . . 0.0 110.124 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.34 -178.31 41.09 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -147.5 133.34 19.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.396 -1.061 . . . . 0.0 109.909 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 5.0 mtm -118.66 -179.91 3.94 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.242 -0.911 . . . . 0.0 110.55 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' B' ' 76' ' ' THR . 21.6 p -142.41 110.15 5.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.307 -0.871 . . . . 0.0 109.973 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.1 tt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.301 -179.767 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.157 0.503 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.3 m -70.47 121.78 84.51 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.495 ' O ' HG22 ' B' ' 4' ' ' ILE . 47.3 Cg_endo -68.84 156.63 64.78 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 124.149 1.605 . . . . 0.0 110.512 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.495 HG22 ' O ' ' B' ' 3' ' ' PRO . 5.1 pt -142.5 168.9 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.349 -0.844 . . . . 0.0 109.887 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.536 ' CG1' HG22 ' B' ' 74' ' ' VAL . 5.3 t -145.76 124.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.206 -0.934 . . . . 0.0 110.269 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.482 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.0 OUTLIER -105.64 119.17 38.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.215 -0.928 . . . . 0.0 110.341 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.45 ' HG ' HG23 ' B' ' 74' ' ' VAL . 1.3 mp -116.56 147.32 41.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.3 -0.875 . . . . 0.0 110.198 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.509 ' O ' ' CD1' ' B' ' 72' ' ' ILE . 11.6 tttt -142.4 168.71 19.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 110.439 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.434 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 151.61 -165.96 30.65 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . 0.477 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 130.84 44.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -1.124 . . . . 0.0 110.196 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.28 -38.79 42.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.868 . . . . 0.0 110.67 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -66.56 -47.1 73.86 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.185 -0.947 . . . . 0.0 110.515 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.1 m -58.01 -28.32 64.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.21 -0.931 . . . . 0.0 110.539 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.486 ' CD2' HD11 ' B' ' 72' ' ' ILE . 77.3 mt -77.37 -26.95 52.37 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 0.0 110.358 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -59.36 -39.67 84.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.194 -0.941 . . . . 0.0 110.343 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.47 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 0.8 OUTLIER -70.2 -34.22 72.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.216 -0.927 . . . . 0.0 110.367 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.503 HD13 ' N ' ' B' ' 17' ' ' LEU . 6.1 mp -58.8 -51.66 69.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.131 -0.98 . . . . 0.0 110.466 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.475 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 1.3 ttp-105 -46.16 -32.36 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.92 . . . . 0.0 110.098 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.47 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 48.8 t80 -64.91 -33.25 75.56 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -74.53 -30.19 61.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.264 -0.897 . . . . 0.0 110.503 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 11.3 m-30 -66.51 -21.58 66.17 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.208 -0.932 . . . . 0.0 110.459 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -63.5 -36.24 83.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.255 -0.903 . . . . 0.0 110.592 -179.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -75.12 -40.94 59.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.218 -0.926 . . . . 0.0 110.411 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.411 ' HB3' ' HB2' ' B' ' 27' ' ' LEU . 15.8 m-70 -95.07 36.28 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.464 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.568 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 31.8 p -57.38 -17.84 14.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.133 -0.98 . . . . 0.0 110.485 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.92 -3.28 42.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.111 -0.993 . . . . 0.0 110.396 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.411 ' HB2' ' HB3' ' B' ' 24' ' ' HIS . 10.9 mt -92.32 -6.22 50.69 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.556 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.568 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 20.7 p90 -145.04 -178.09 5.87 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.202 -0.936 . . . . 0.0 109.635 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 48.0 m -96.44 -69.19 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.91 -1.119 . . . . 0.0 110.589 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.46 20.99 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.955 -1.091 . . . . 0.0 109.065 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.464 ' CG1' ' O ' ' B' ' 31' ' ' VAL . 14.3 p -91.37 113.32 26.75 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.938 0 O-C-N 121.712 -0.617 . . . . 0.0 110.39 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.434 ' OG ' ' HB ' ' B' ' 50' ' ' THR . 70.7 p -53.08 152.55 4.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.006 -1.059 . . . . 0.0 109.56 179.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' SER . . . . . 0.472 ' OG ' ' HB2' ' A' ' 35' ' ' TRP . 0.9 OUTLIER -60.77 154.45 21.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.014 -1.054 . . . . 0.0 109.98 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -67.63 130.23 42.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.161 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.453 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 44.1 p-90 -146.09 176.04 10.02 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.313 -0.867 . . . . 0.0 109.929 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.478 ' CG ' ' H ' ' B' ' 37' ' ' TRP . 53.7 t-80 -162.55 178.05 8.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.427 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.478 ' H ' ' CG ' ' B' ' 36' ' ' HIS . 79.6 m95 -78.5 123.78 27.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.276 -0.89 . . . . 0.0 110.067 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' THR . . . . . 0.44 ' OG1' ' O ' ' B' ' 37' ' ' TRP . 1.7 m . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.32 -0.863 . . . . 0.0 109.869 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.474 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.311 0.577 . . . . 0.0 110.008 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.474 HG13 ' C ' ' B' ' 47' ' ' ALA . 70.2 mt -142.12 144.29 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.18 -0.95 . . . . 0.0 110.318 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 70.8 t -116.65 169.16 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 0.0 110.498 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.438 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 17.2 m -146.04 152.96 40.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.295 -0.878 . . . . 0.0 109.804 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -136.01 128.47 30.43 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.132 -0.98 . . . . 0.0 110.232 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.417 ' OG1' ' CZ3' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.93 39.92 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.208 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.573 ' CD2' ' HA ' ' B' ' 59' ' ' ARG . 38.3 m-85 -112.31 147.69 35.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.264 -0.898 . . . . 0.0 110.034 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -93.45 -3.18 53.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.822 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 98.8 p -157.44 121.38 4.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.015 -1.053 . . . . 0.0 110.372 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.465 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 2.3 mt-10 -46.99 -42.18 17.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.314 -0.867 . . . . 0.0 109.978 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . 0.429 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 16.1 t-105 -53.94 -55.83 23.38 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -59.23 -31.06 68.71 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.408 -0.807 . . . . 0.0 110.52 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.573 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 0.0 OUTLIER -59.41 -54.7 43.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.18 -0.95 . . . . 0.0 110.96 -179.645 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . 0.418 ' O ' ' CB ' ' B' ' 64' ' ' SER . 19.6 t70 -61.12 -31.3 71.01 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.174 -0.954 . . . . 0.0 110.893 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.442 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 51.3 mt-30 -65.76 -46.55 78.39 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.116 -0.99 . . . . 0.0 110.668 -179.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.476 ' CD2' ' N ' ' B' ' 63' ' ' LEU . 41.5 t80 -56.43 -67.84 0.27 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.242 -0.911 . . . . 0.0 111.04 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . 0.476 ' N ' ' CD2' ' B' ' 62' ' ' PHE . 4.1 pp -59.14 -12.93 5.78 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.306 -0.872 . . . . 0.0 110.792 -179.094 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 11.2 t -88.46 -23.36 23.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.172 -0.955 . . . . 0.0 109.901 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 3.5 mm-40 -98.2 -44.63 6.51 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.444 -0.785 . . . . 0.0 110.02 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.407 ' CG1' ' O ' ' B' ' 62' ' ' PHE . 1.9 p -98.12 90.9 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.359 -0.838 . . . . 0.0 110.008 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . 0.441 ' C ' HG12 ' B' ' 68' ' ' ILE . 19.0 pttp -64.48 -176.88 0.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.413 -0.804 . . . . 0.0 110.48 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.559 ' CG2' ' HD2' ' B' ' 69' ' ' PRO . 0.1 OUTLIER -151.44 149.93 25.55 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.405 -0.809 . . . . 0.0 109.682 -179.847 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.559 ' HD2' ' CG2' ' B' ' 68' ' ' ILE . 45.3 Cg_endo -49.35 -178.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.779 1.41 . . . . 0.0 110.655 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -4.0 43.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.288 -0.882 . . . . 0.0 110.581 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.63 -23.29 29.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.151 -0.968 . . . . 0.0 110.078 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.509 ' CD1' ' O ' ' B' ' 8' ' ' LYS . 1.9 tp -94.47 106.59 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 110.112 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' THR . . . . . 0.402 HG21 ' N ' ' B' ' 74' ' ' VAL . 26.8 m -97.35 156.06 16.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.044 -1.035 . . . . 0.0 109.408 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.536 HG22 ' CG1' ' B' ' 5' ' ' VAL . 6.0 p -143.91 138.39 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.85 -1.14 . . . . 0.0 111.63 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -179.37 3.98 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.009 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' THR . . . . . 0.436 ' O ' ' OG ' ' A' ' 80' ' ' SER . 5.5 p -128.19 155.46 44.47 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.01 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.72 -178.32 41.31 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -147.5 133.52 19.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.336 -1.097 . . . . 0.0 110.05 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 5.0 mtm -118.81 179.74 4.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.341 -0.85 . . . . 0.0 110.323 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 21.6 p -142.07 110.17 5.91 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.379 -0.825 . . . . 0.0 109.88 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.463 HG22 ' O ' ' B' ' 81' ' ' ILE . 13.8 tt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.384 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.4 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.222 0.534 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.43 142.65 89.51 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.262 -0.899 . . . . 0.0 110.107 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.502 ' O ' HG23 ' A' ' 4' ' ' ILE . 45.3 Cg_endo -92.5 137.22 1.6 Allowed 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.97 1.511 . . . . 0.0 110.227 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.502 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.0 OUTLIER -142.8 176.05 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.861 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.548 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 12.4 p -146.11 153.69 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.199 -0.938 . . . . 0.0 110.466 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.578 ' CD2' HG22 ' A' ' 50' ' ' THR . 0.2 OUTLIER -133.75 108.89 8.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.481 -0.762 . . . . 0.0 109.765 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.513 ' HA ' ' O ' ' A' ' 73' ' ' THR . 2.4 pp -120.89 162.44 19.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.685 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 31.3 pttt -139.58 166.4 24.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.317 -0.864 . . . . 0.0 110.22 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.422 ' O ' HD13 ' A' ' 14' ' ' LEU . . . 167.11 178.72 39.65 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -65.34 136.4 56.48 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.304 -1.116 . . . . 0.0 110.508 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.08 -24.43 2.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.232 -0.917 . . . . 0.0 110.18 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -81.37 -51.38 8.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -57.86 -16.73 12.76 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.286 -0.883 . . . . 0.0 109.905 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.422 HD13 ' O ' ' A' ' 9' ' ' GLY . 15.7 mt -90.89 -28.98 17.77 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -0.838 . . . . 0.0 110.135 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -60.19 -48.83 80.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.277 -0.889 . . . . 0.0 110.675 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.2 t -70.02 -34.91 73.89 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 110.763 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.73 -48.1 82.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.148 -0.97 . . . . 0.0 110.56 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.529 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 72.0 ttt-85 -47.69 -32.51 5.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.648 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -64.12 -25.81 68.26 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.945 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -73.68 -32.93 64.21 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.206 -0.934 . . . . 0.0 109.631 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.57 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 7.2 m-30 -66.72 -8.19 26.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.37 -0.831 . . . . 0.0 110.191 179.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . 0.416 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 33.7 mmtt -63.06 -49.82 73.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.157 -0.965 . . . . 0.0 109.856 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -75.29 -25.93 58.33 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.248 -0.907 . . . . 0.0 109.772 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 18.1 m170 -95.27 29.61 2.45 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.377 -0.827 . . . . 0.0 110.018 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 p -57.26 -19.59 22.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.111 -0.993 . . . . 0.0 110.177 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.7 t -97.09 9.32 42.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.469 ' HB2' ' O ' ' A' ' 24' ' ' HIS . 4.2 mp -92.38 -33.07 14.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.123 -0.986 . . . . 0.0 110.628 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.5 p90 -118.76 168.88 10.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.964 -1.085 . . . . 0.0 110.255 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.67 -31.59 11.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.604 ' HB2' ' CE3' ' B' ' 37' ' ' TRP . . . -159.77 116.23 2.52 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.152 -0.967 . . . . 0.0 110.582 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.552 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 11.3 p -90.11 101.57 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.157 -0.964 . . . . 0.0 110.268 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.588 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 54.9 p -50.41 153.02 1.67 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.135 -0.978 . . . . 0.0 110.484 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.475 ' O ' ' OG1' ' A' ' 34' ' ' THR . 91.5 p -61.27 -96.43 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.274 -0.891 . . . . 0.0 110.506 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.475 ' OG1' ' O ' ' A' ' 33' ' ' SER . 3.2 m -171.55 125.19 0.6 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.414 -0.804 . . . . 0.0 110.036 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.535 ' CE3' ' HB2' ' B' ' 32' ' ' SER . 33.6 p-90 -147.09 -168.61 3.09 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.374 -0.829 . . . . 0.0 110.053 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.505 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 82.6 t60 -162.64 171.14 17.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.26 -0.9 . . . . 0.0 110.183 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.569 ' CE3' ' HB2' ' B' ' 30' ' ' ALA . 4.4 m95 -79.85 99.11 7.37 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.15 -0.969 . . . . 0.0 110.054 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.469 ' O ' ' CG1' ' B' ' 31' ' ' VAL . 2.3 m . . . . . 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 110.013 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.524 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.188 0.518 . . . . 0.0 110.168 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.524 HG13 ' C ' ' A' ' 47' ' ' ALA . 64.4 mt -142.42 162.13 18.92 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.177 -0.952 . . . . 0.0 110.102 -179.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.505 ' N ' HG21 ' A' ' 48' ' ' ILE . 4.6 t -135.95 167.98 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.702 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.578 HG22 ' CD2' ' A' ' 6' ' ' HIS . 82.9 m -145.99 153.81 41.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.603 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.548 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 0.5 OUTLIER -136.33 136.04 39.37 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.045 -1.035 . . . . 0.0 110.219 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.529 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.61 125.28 40.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.444 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.479 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 38.1 m-85 -108.83 147.37 32.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 110.133 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -95.37 -16.92 22.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -140.26 126.84 20.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.184 -0.947 . . . . 0.0 110.296 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 4.3 mt-10 -53.99 -42.97 69.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.244 -0.91 . . . . 0.0 110.23 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 t-105 -53.58 -48.31 69.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -58.84 -36.31 74.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.371 -0.831 . . . . 0.0 110.088 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.508 ' NH2' HG22 ' A' ' 76' ' ' THR . 2.2 tmt_? -59.45 -45.51 91.4 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -60.99 -38.25 85.36 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.137 -0.977 . . . . 0.0 110.674 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -65.51 -39.23 91.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 110.53 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.464 ' CD1' ' N ' ' A' ' 63' ' ' LEU . 30.5 t80 -56.24 -65.2 0.65 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.356 -0.84 . . . . 0.0 111.036 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.482 ' C ' ' CD1' ' A' ' 63' ' ' LEU . 4.6 pp -59.64 -10.31 3.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.221 -0.924 . . . . 0.0 110.841 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.5 t -92.41 -23.61 19.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.098 -1.001 . . . . 0.0 110.699 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -95.5 -28.25 14.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.077 -1.015 . . . . 0.0 110.716 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 62' ' ' PHE . 3.5 m -109.37 75.07 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.044 -1.035 . . . . 0.0 110.138 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -50.83 111.57 0.57 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.288 -0.882 . . . . 0.0 110.229 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.46 HG23 ' HB ' ' A' ' 72' ' ' ILE . 0.5 OUTLIER -87.62 139.28 31.47 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 110.065 -179.647 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.458 ' HD2' HG23 ' A' ' 68' ' ' ILE . 46.2 Cg_endo -56.5 179.01 0.11 Allowed 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.211 1.637 . . . . 0.0 110.56 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -86.36 -0.62 56.3 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.338 -0.851 . . . . 0.0 110.195 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.0 p -84.42 -30.5 25.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.282 -0.886 . . . . 0.0 109.765 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 50.8 mt -94.34 114.76 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.013 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 7.0 m -95.53 146.08 24.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.195 -0.941 . . . . 0.0 109.933 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.526 ' CG2' ' CG2' ' A' ' 5' ' ' VAL . 8.2 p -145.2 154.32 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.129 -0.982 . . . . 0.0 110.749 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.431 ' N ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -139.99 -179.23 5.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 109.876 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.508 HG22 ' NH2' ' A' ' 59' ' ' ARG . 52.4 p -107.09 163.81 12.68 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.381 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.411 ' HA3' HD12 ' A' ' 4' ' ' ILE . . . -165.45 -177.86 38.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -147.9 144.15 27.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.201 -1.176 . . . . 0.0 110.333 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 97.2 mtp -115.29 172.46 7.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.265 -0.897 . . . . 0.0 110.147 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.462 ' HB3' ' O ' ' B' ' 76' ' ' THR . 2.2 t -132.72 101.76 5.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.937 . . . . 0.0 110.483 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.438 HG23 ' O ' ' A' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.126 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mtp . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.246 0.546 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.97 143.81 92.22 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.266 -0.896 . . . . 0.0 110.27 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.499 ' O ' HG23 ' B' ' 4' ' ' ILE . 46.3 Cg_endo -93.4 137.14 1.29 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 O-C-N 124.03 1.542 . . . . 0.0 110.362 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.499 HG23 ' O ' ' B' ' 3' ' ' PRO . 1.0 OUTLIER -143.13 176.73 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.391 -0.818 . . . . 0.0 110.025 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 74' ' ' VAL . 12.3 p -146.44 154.04 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 110.413 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.514 ' CD2' HG22 ' B' ' 50' ' ' THR . 0.2 OUTLIER -133.92 108.42 8.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 0.0 109.667 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.514 ' HA ' ' O ' ' B' ' 73' ' ' THR . 2.5 pp -120.55 162.45 19.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.963 . . . . 0.0 110.687 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 31.9 pttt -139.69 166.31 24.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.26 -0.9 . . . . 0.0 110.256 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.438 ' O ' HD13 ' B' ' 14' ' ' LEU . . . 167.17 178.36 39.45 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -65.02 136.89 57.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.42 -1.047 . . . . 0.0 110.405 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.38 -25.13 3.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.325 -0.859 . . . . 0.0 110.117 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -80.52 -51.61 8.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.317 -0.864 . . . . 0.0 110.188 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 18.6 m -57.87 -16.54 12.14 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.248 -0.907 . . . . 0.0 110.041 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.438 HD13 ' O ' ' B' ' 9' ' ' GLY . 16.6 mt -91.16 -28.74 17.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 110.237 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 18.0 ttmt -60.15 -48.67 80.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.29 -0.881 . . . . 0.0 110.638 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -70.15 -34.98 73.7 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.172 -0.955 . . . . 0.0 110.865 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.65 -48.12 82.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.064 -1.023 . . . . 0.0 110.505 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.539 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 71.4 ttt-85 -47.63 -32.64 5.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.593 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -64.28 -25.17 67.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -0.982 . . . . 0.0 109.953 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -74.69 -32.71 62.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.318 -0.864 . . . . 0.0 109.5 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 7.5 m-30 -66.65 -8.17 25.65 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 110.117 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' B' ' 22' ' ' LYS . 35.2 mmtt -63.14 -50.09 71.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -75.14 -25.74 58.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.779 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.487 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 18.1 m170 -95.34 29.34 2.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.366 -0.834 . . . . 0.0 110.14 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 14.3 p -57.04 -19.73 20.6 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.104 -0.997 . . . . 0.0 110.208 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -97.06 9.54 41.82 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.851 . . . . 0.0 110.209 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' B' ' 24' ' ' HIS . 4.2 mp -92.31 -34.13 14.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.22 -0.925 . . . . 0.0 110.564 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -117.9 168.92 10.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.005 -1.06 . . . . 0.0 110.417 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.71 -31.48 11.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.312 -0.867 . . . . 0.0 110.828 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . 0.569 ' HB2' ' CE3' ' A' ' 37' ' ' TRP . . . -159.67 116.47 2.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.054 -1.029 . . . . 0.0 110.58 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.545 ' CG1' ' O ' ' B' ' 31' ' ' VAL . 12.0 p -90.27 101.12 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.116 -0.99 . . . . 0.0 110.333 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.535 ' HB2' ' CE3' ' A' ' 35' ' ' TRP . 60.0 p -50.38 152.51 1.82 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.081 -1.012 . . . . 0.0 110.376 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' SER . . . . . 0.498 ' OG ' ' N ' ' B' ' 34' ' ' THR . 85.6 p -61.23 -95.93 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.884 . . . . 0.0 110.5 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.498 ' N ' ' OG ' ' B' ' 33' ' ' SER . 3.2 m -171.64 125.45 0.59 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.461 -0.774 . . . . 0.0 110.054 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.588 ' CE3' ' HB2' ' A' ' 32' ' ' SER . 36.1 p-90 -147.11 -168.77 3.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.375 -0.828 . . . . 0.0 110.075 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.498 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 82.2 t60 -162.58 170.77 18.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.146 -0.971 . . . . 0.0 110.079 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.604 ' CE3' ' HB2' ' A' ' 30' ' ' ALA . 4.5 m95 -79.91 98.34 7.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.112 -0.992 . . . . 0.0 110.154 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' THR . . . . . 0.53 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 2.3 m . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 0.0 110.189 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.522 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.251 0.548 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.522 HG13 ' C ' ' B' ' 47' ' ' ALA . 64.2 mt -142.38 162.43 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.227 -0.921 . . . . 0.0 110.12 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . 0.498 ' N ' HG21 ' B' ' 48' ' ' ILE . 4.9 t -136.49 168.05 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.098 -1.001 . . . . 0.0 110.725 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.514 HG22 ' CD2' ' B' ' 6' ' ' HIS . 78.4 m -145.94 153.87 41.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.439 -0.788 . . . . 0.0 109.677 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.534 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 0.5 OUTLIER -136.52 135.89 38.89 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.08 -1.013 . . . . 0.0 110.295 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.466 ' OG1' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.59 124.98 40.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.505 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.48 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 40.5 m-85 -108.71 147.46 31.92 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.344 -0.848 . . . . 0.0 110.076 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -95.29 -17.66 21.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.094 -1.004 . . . . 0.0 110.273 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -139.22 127.33 22.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.403 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 4.2 mt-10 -54.37 -42.63 70.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 110.264 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -53.7 -48.45 69.55 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.209 -0.932 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -58.94 -36.04 74.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.098 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.515 ' NH2' HG22 ' B' ' 76' ' ' THR . 1.8 tmt_? -59.2 -45.73 90.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -0.847 . . . . 0.0 110.915 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.02 -37.94 84.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.027 -1.046 . . . . 0.0 110.774 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -65.67 -38.96 90.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.15 -0.968 . . . . 0.0 110.448 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' B' ' 63' ' ' LEU . 31.4 t80 -56.25 -65.17 0.65 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.227 -0.921 . . . . 0.0 110.987 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . 0.474 ' CD1' ' C ' ' B' ' 63' ' ' LEU . 4.6 pp -59.59 -11.54 5.0 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.292 -0.88 . . . . 0.0 110.951 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 4.8 t -91.11 -23.48 20.28 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.014 -1.054 . . . . 0.0 110.663 -179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -95.57 -28.58 14.78 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.093 -1.005 . . . . 0.0 110.769 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.4 HG22 ' O ' ' B' ' 62' ' ' PHE . 3.5 m -109.02 74.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.095 -1.003 . . . . 0.0 110.231 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -50.12 111.67 0.56 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.382 -0.823 . . . . 0.0 110.108 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.469 HG23 ' HD2' ' B' ' 69' ' ' PRO . 0.5 OUTLIER -87.67 139.56 31.41 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.085 -1.01 . . . . 0.0 110.035 -179.638 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.469 ' HD2' HG23 ' B' ' 68' ' ' ILE . 47.3 Cg_endo -56.85 178.92 0.12 Allowed 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 124.156 1.608 . . . . 0.0 110.518 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -86.07 -0.8 56.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 58.8 p -84.41 -30.29 25.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.19 -0.944 . . . . 0.0 109.7 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.482 ' HA ' ' O ' ' B' ' 8' ' ' LYS . 47.9 mt -94.51 114.68 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.394 -0.816 . . . . 0.0 110.079 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' THR . . . . . 0.514 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.0 m -95.42 146.23 24.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 110.002 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 5' ' ' VAL . 8.4 p -145.22 154.34 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.159 -0.963 . . . . 0.0 110.857 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' SER . . . . . 0.429 ' N ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -140.43 -179.5 6.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.493 -0.754 . . . . 0.0 109.89 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' THR . . . . . 0.515 HG22 ' NH2' ' B' ' 59' ' ' ARG . 54.2 p -106.73 163.87 12.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.196 -0.94 . . . . 0.0 110.344 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -165.47 -177.52 37.87 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -148.24 144.23 27.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.151 -1.205 . . . . 0.0 110.347 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 96.6 mtp -115.18 172.95 6.76 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.283 -0.885 . . . . 0.0 110.108 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.434 ' O ' HG23 ' B' ' 81' ' ' ILE . 2.2 t -133.21 102.36 5.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 0.0 110.312 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.434 HG23 ' O ' ' B' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.41 ' HE3' ' O ' ' A' ' 79' ' ' MET . 3.4 mmm . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 121.306 0.574 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.522 ' O ' ' CG ' ' A' ' 79' ' ' MET . 0.3 OUTLIER -103.14 101.31 21.2 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 110.186 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.508 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -56.37 164.42 5.42 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.904 1.476 . . . . 0.0 110.243 -179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' A' ' 77' ' ' GLY . 1.3 pt -144.01 125.39 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.172 -0.955 . . . . 0.0 110.187 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.528 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 5.6 p -94.34 132.56 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.211 -0.931 . . . . 0.0 110.246 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.552 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -105.28 126.23 51.87 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.767 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.482 ' CD1' ' CG2' ' A' ' 72' ' ' ILE . 13.0 tp -115.01 133.65 55.86 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.16 -0.962 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.1 tttt -141.15 166.38 24.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.335 -0.853 . . . . 0.0 109.974 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.509 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.32 -171.55 32.22 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.751 -1.339 . . . . 0.0 109.751 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.0 136.08 56.38 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -1.158 . . . . 0.0 110.39 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.81 -48.41 59.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.303 -0.873 . . . . 0.0 110.652 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.8 -56.17 13.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.082 -1.011 . . . . 0.0 110.487 -179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.401 HG22 HD13 ' A' ' 72' ' ' ILE . 4.4 m -58.19 -26.0 62.26 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.164 -0.96 . . . . 0.0 110.786 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.491 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 56.1 mt -71.86 -31.89 66.92 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.117 -0.989 . . . . 0.0 110.379 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -59.69 -42.7 93.53 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.216 -0.928 . . . . 0.0 110.567 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.4 -37.53 74.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.212 -0.93 . . . . 0.0 111.002 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.458 HD12 HG12 ' A' ' 72' ' ' ILE . 42.8 mt -58.8 -55.44 35.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.071 -1.018 . . . . 0.0 110.594 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttp85 -45.59 -21.55 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.241 -0.912 . . . . 0.0 110.919 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 17' ' ' LEU . 67.0 t80 -64.41 -59.33 4.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.083 -1.011 . . . . 0.0 110.678 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.5 mtt-85 -68.16 -14.72 63.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 0.0 110.417 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.62 -41.05 88.98 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.253 -0.904 . . . . 0.0 110.573 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -63.51 -25.13 68.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.171 -0.955 . . . . 0.0 110.668 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -75.28 -38.66 60.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 110.575 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.533 ' HB3' ' CD1' ' A' ' 27' ' ' LEU . 23.1 m-70 -94.73 45.25 1.11 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.399 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.588 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 20.0 p -57.32 -16.1 7.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.349 -0.844 . . . . 0.0 110.229 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.448 HG22 ' SG ' ' A' ' 25' ' ' CYS . 65.3 p -96.85 3.62 52.11 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.454 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.533 ' CD1' ' HB3' ' A' ' 24' ' ' HIS . 8.0 mt -91.75 -26.28 18.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 0.0 110.137 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.588 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 44.0 p90 -122.13 174.22 7.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.158 -0.964 . . . . 0.0 109.936 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.6 m -101.0 -36.36 9.05 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.118 -0.989 . . . . 0.0 111.949 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.493 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -160.51 123.99 3.47 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.855 -1.153 . . . . 0.0 110.941 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.509 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 8.5 p -89.62 120.46 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.176 -0.952 . . . . 0.0 110.049 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.625 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 4.4 p -84.21 150.18 25.64 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.321 -0.862 . . . . 0.0 110.953 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.39 158.52 14.4 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.523 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.5 m -67.77 134.58 51.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.021 -1.049 . . . . 0.0 109.962 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.668 ' CD2' ' O ' ' A' ' 35' ' ' TRP . 46.9 p-90 -145.49 120.7 10.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.106 -0.996 . . . . 0.0 109.917 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.6 ' CD2' HG21 ' A' ' 38' ' ' THR . 0.3 OUTLIER -79.02 161.29 26.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.212 -0.93 . . . . 0.0 110.614 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.57 ' HA ' ' CE3' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -78.62 55.5 1.66 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.929 179.761 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.6 HG21 ' CD2' ' A' ' 36' ' ' HIS . 6.0 t . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.197 -0.939 . . . . 0.0 110.228 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.284 0.564 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.429 ' CG2' ' O ' ' A' ' 7' ' ' LEU . 25.9 mt -141.5 140.97 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.162 -0.961 . . . . 0.0 110.599 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 48.5 t -121.94 117.81 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.386 -0.821 . . . . 0.0 109.933 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.431 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 39.2 m -94.15 154.63 17.48 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.192 -0.943 . . . . 0.0 110.49 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.528 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 5.6 mp -135.91 134.72 39.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.234 -0.916 . . . . 0.0 109.889 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.567 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.85 127.49 42.88 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.324 -0.86 . . . . 0.0 110.757 -179.44 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.508 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 15.9 m-85 -109.13 147.84 31.82 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.459 -0.775 . . . . 0.0 109.976 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -88.22 -10.09 50.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.23 -0.919 . . . . 0.0 110.765 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.19 132.42 10.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.116 -0.99 . . . . 0.0 110.319 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 30.1 mm-40 -54.47 -38.15 66.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.304 -0.873 . . . . 0.0 110.054 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -53.65 -53.54 50.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.025 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -57.07 -27.23 61.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.421 -0.8 . . . . 0.0 110.256 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 25.0 ttt-85 -59.62 -49.57 77.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.182 -0.949 . . . . 0.0 110.257 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -61.37 -33.09 73.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.364 -0.835 . . . . 0.0 110.914 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -65.19 -49.59 69.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.988 -1.07 . . . . 0.0 110.158 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.529 ' C ' ' CD1' ' A' ' 62' ' ' PHE . 0.6 OUTLIER -55.4 -41.43 72.69 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.214 -0.929 . . . . 0.0 109.639 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.6 mt -59.77 -24.61 64.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.426 -0.796 . . . . 0.0 110.374 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.7 p -91.77 -19.01 23.04 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.165 -0.959 . . . . 0.0 110.32 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.74 -17.26 20.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.21 -0.931 . . . . 0.0 110.141 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.9 t -102.17 97.46 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.319 -0.863 . . . . 0.0 110.329 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.524 ' O ' ' CD ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -56.62 104.52 0.15 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.224 -0.922 . . . . 0.0 110.15 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.46 HG23 ' HB ' ' A' ' 72' ' ' ILE . 7.0 mt -89.85 136.44 29.23 Favored Pre-proline 0 C--N 1.301 -1.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.278 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.429 ' HG2' HD11 ' A' ' 72' ' ' ILE . 45.8 Cg_endo -76.76 -158.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.034 1.544 . . . . 0.0 110.214 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.0 mttp -100.92 45.38 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.491 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.69 -10.87 0.13 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.063 -1.023 . . . . 0.0 112.1 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.581 ' N ' ' CD1' ' A' ' 72' ' ' ILE . 1.2 mp -94.2 113.74 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 120.596 -1.315 . . . . 0.0 109.962 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.5 m -95.59 144.38 26.09 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.104 -0.997 . . . . 0.0 110.449 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.7 t -90.15 167.09 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 111.085 -178.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.552 ' HB2' ' CB ' ' A' ' 6' ' ' HIS . 1.2 m -144.39 164.45 30.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.671 -0.643 . . . . 0.0 110.895 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.7 p -133.93 156.22 48.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.438 -0.788 . . . . 0.0 109.282 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' A' ' 4' ' ' ILE . . . 176.11 138.58 2.9 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -92.57 140.56 29.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.129 -1.218 . . . . 0.0 110.255 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.522 ' CG ' ' O ' ' A' ' 2' ' ' THR . 2.8 ppp? -126.91 168.55 14.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.138 -0.976 . . . . 0.0 110.309 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.463 ' O ' HG13 ' A' ' 81' ' ' ILE . 0.5 OUTLIER -148.86 108.97 4.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.243 -0.91 . . . . 0.0 110.25 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 80' ' ' SER . 27.7 mt . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.194 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.435 ' HE3' ' O ' ' B' ' 79' ' ' MET . 3.2 mmm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.278 0.561 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' THR . . . . . 0.546 ' O ' ' CG ' ' B' ' 79' ' ' MET . 0.3 OUTLIER -102.84 100.52 16.86 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.216 -0.927 . . . . 0.0 110.285 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.3 Cg_endo -55.5 164.58 4.01 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 O-C-N 123.974 1.513 . . . . 0.0 110.325 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' B' ' 77' ' ' GLY . 1.3 pt -144.29 125.1 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.936 . . . . 0.0 110.227 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.522 ' CG1' ' HB2' ' B' ' 51' ' ' LEU . 5.5 p -94.23 132.41 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.13 -0.981 . . . . 0.0 110.303 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.556 ' CB ' ' HB2' ' B' ' 75' ' ' SER . 0.0 OUTLIER -105.07 126.5 52.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 109.9 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.473 ' CD1' ' CG2' ' B' ' 72' ' ' ILE . 13.4 tp -115.34 133.57 55.91 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.089 -1.007 . . . . 0.0 110.591 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.521 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 8.7 tttt -141.2 166.47 24.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.326 -0.859 . . . . 0.0 109.885 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.521 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.53 -171.28 32.36 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.96 136.27 56.62 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.36 -1.083 . . . . 0.0 110.354 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.493 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.7 -49.38 57.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.382 -0.823 . . . . 0.0 110.607 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.11 -56.13 12.15 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.704 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.4 HG22 HD13 ' B' ' 72' ' ' ILE . 4.2 m -58.0 -26.85 62.91 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.182 -0.949 . . . . 0.0 110.846 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 60.1 mt -70.98 -31.86 68.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.104 -0.998 . . . . 0.0 110.52 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -59.75 -42.66 93.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.625 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 6.0 t -70.17 -37.32 75.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.195 -0.941 . . . . 0.0 110.837 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.465 HD12 HG12 ' B' ' 72' ' ' ILE . 48.7 mt -58.8 -55.81 30.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.252 -0.905 . . . . 0.0 110.708 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ttp85 -45.75 -21.16 0.1 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.88 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' B' ' 17' ' ' LEU . 67.2 t80 -64.58 -60.18 3.42 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.025 -1.047 . . . . 0.0 110.527 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 48.2 mtt-85 -67.48 -14.73 63.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.165 -0.96 . . . . 0.0 110.473 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.64 -40.83 88.87 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.193 -0.942 . . . . 0.0 110.585 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 20.4 mmtp -63.37 -25.45 68.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.26 -0.9 . . . . 0.0 110.677 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.18 -39.04 60.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 110.574 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.512 ' HB3' ' CD1' ' B' ' 27' ' ' LEU . 23.9 m-70 -94.35 45.12 1.12 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.083 -1.011 . . . . 0.0 110.276 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.604 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 20.9 p -57.14 -15.91 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.212 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.434 HG22 ' SG ' ' B' ' 25' ' ' CYS . 80.4 p -96.86 3.09 52.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.325 -0.859 . . . . 0.0 110.446 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.512 ' CD1' ' HB3' ' B' ' 24' ' ' HIS . 8.2 mt -91.75 -25.64 18.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.158 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 44.5 p90 -122.5 173.82 7.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.147 -0.971 . . . . 0.0 109.958 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -100.69 -36.13 9.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.986 -1.071 . . . . 0.0 111.742 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . 0.485 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -160.68 123.93 3.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.845 -1.159 . . . . 0.0 111.059 -179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.508 ' CG1' ' O ' ' B' ' 31' ' ' VAL . 8.7 p -89.47 119.95 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.161 -0.962 . . . . 0.0 110.037 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.629 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 3.9 p -83.92 150.82 25.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.298 -0.876 . . . . 0.0 110.832 -179.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.45 158.81 13.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.027 -1.045 . . . . 0.0 109.734 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.0 m -68.01 134.76 51.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.028 -1.045 . . . . 0.0 109.899 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.664 ' CD2' ' O ' ' B' ' 35' ' ' TRP . 46.1 p-90 -145.83 120.6 9.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.101 -1.0 . . . . 0.0 109.937 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.588 ' CD2' HG21 ' B' ' 38' ' ' THR . 0.3 OUTLIER -78.94 161.3 26.78 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.235 -0.915 . . . . 0.0 110.593 -179.646 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.579 ' HA ' ' CE3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -78.65 53.48 1.34 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.259 -0.9 . . . . 0.0 110.165 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' THR . . . . . 0.588 HG21 ' CD2' ' B' ' 36' ' ' HIS . 6.6 t . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.363 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 121.244 0.545 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.466 HG12 ' HG3' ' B' ' 8' ' ' LYS . 40.8 mt -141.87 140.99 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.2 -0.937 . . . . 0.0 110.617 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 48.1 t -121.67 117.81 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 0.0 109.943 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.453 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 34.9 m -93.95 154.32 17.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 110.374 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.522 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 5.7 mp -135.81 134.78 39.27 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 109.804 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.558 ' OG1' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.84 127.59 42.97 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 110.627 -179.542 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.501 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 16.1 m-85 -109.43 148.02 31.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.449 -0.782 . . . . 0.0 109.737 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -88.25 -9.73 51.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.131 -0.981 . . . . 0.0 110.725 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.07 133.01 10.51 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 28.5 mm-40 -55.31 -38.34 68.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -0.875 . . . . 0.0 109.984 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -53.57 -53.29 53.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.34 -0.85 . . . . 0.0 109.884 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -56.72 -27.99 60.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 110.143 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.444 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 24.0 ttt-85 -59.54 -49.17 78.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.19 -0.944 . . . . 0.0 110.395 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -61.47 -33.02 73.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.242 -0.911 . . . . 0.0 110.899 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -65.37 -49.85 67.74 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.152 -0.968 . . . . 0.0 110.063 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.525 ' C ' ' CD1' ' B' ' 62' ' ' PHE . 0.6 OUTLIER -55.52 -41.11 72.69 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.275 -0.891 . . . . 0.0 109.642 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 2.6 mt -59.75 -25.58 64.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.413 -0.804 . . . . 0.0 110.178 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 26.0 p -90.48 -19.5 23.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.62 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.83 -17.1 20.42 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.41 HG23 ' CD2' ' B' ' 62' ' ' PHE . 34.8 t -102.04 96.94 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.211 -0.931 . . . . 0.0 110.374 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . 0.526 ' CD ' ' O ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -56.13 104.32 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 110.254 179.872 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.458 HG23 ' HB ' ' B' ' 72' ' ' ILE . 6.8 mt -89.88 136.88 28.66 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.92 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.44 ' HG2' HD11 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -77.19 -157.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.127 1.593 . . . . 0.0 110.296 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 39.3 mttp -101.5 45.24 0.98 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 110.368 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.76 -10.72 0.13 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.094 -1.004 . . . . 0.0 112.04 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.576 ' N ' ' CD1' ' B' ' 72' ' ' ILE . 1.2 mp -94.38 113.84 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 120.553 -1.342 . . . . 0.0 109.971 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m -95.44 144.24 26.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.037 -1.039 . . . . 0.0 110.351 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 t -90.13 167.14 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 111.084 -178.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' SER . . . . . 0.556 ' HB2' ' CB ' ' B' ' 6' ' ' HIS . 1.3 m -144.59 163.72 33.06 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.409 0.623 . . . . 0.0 110.955 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.3 p -133.13 156.91 46.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.5 -0.75 . . . . 0.0 109.222 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' B' ' 4' ' ' ILE . . . 175.69 138.72 2.89 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -92.71 140.63 29.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.074 -1.251 . . . . 0.0 110.243 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.546 ' CG ' ' O ' ' B' ' 2' ' ' THR . 2.7 ppp? -126.55 169.38 13.13 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 110.19 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.46 ' O ' HG13 ' B' ' 81' ' ' ILE . 0.5 OUTLIER -149.95 108.77 3.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.216 -0.928 . . . . 0.0 110.127 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.46 HG13 ' O ' ' B' ' 80' ' ' SER . 27.0 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.583 ' HB2' ' CE2' ' A' ' 78' ' ' PHE . 1.8 mtp . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.116 0.484 . . . . 0.0 110.094 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -98.79 122.34 53.27 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.133 -0.979 . . . . 0.0 110.734 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.518 ' O ' HG23 ' A' ' 4' ' ' ILE . 46.7 Cg_endo -80.41 164.04 21.65 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 124.023 1.538 . . . . 0.0 109.716 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.518 HG23 ' O ' ' A' ' 3' ' ' PRO . 4.7 pt -143.26 124.0 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.07 -1.018 . . . . 0.0 110.755 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.427 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 11.2 p -95.14 124.68 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.441 -0.787 . . . . 0.0 110.353 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.486 ' O ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -107.24 127.57 53.65 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.154 -0.966 . . . . 0.0 110.272 179.755 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.479 ' HA ' ' O ' ' A' ' 73' ' ' THR . 0.7 OUTLIER -129.29 153.58 47.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.06 -1.025 . . . . 0.0 110.507 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.478 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 1.2 ttpm? -141.85 169.8 16.91 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.179 -0.951 . . . . 0.0 110.2 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.478 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.22 -175.46 31.66 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -65.05 146.47 54.96 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -1.076 . . . . 0.0 110.549 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.42 -48.64 56.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.343 -0.848 . . . . 0.0 110.421 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.435 ' OD1' ' N ' ' A' ' 12' ' ' ASN . 3.3 m120 -53.93 -48.87 69.78 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.156 -0.965 . . . . 0.0 110.678 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.46 HG22 ' OG1' ' A' ' 71' ' ' THR . 0.2 OUTLIER -58.27 -20.61 43.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.239 -0.913 . . . . 0.0 110.98 -179.604 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 51.5 mt -75.61 -39.41 57.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.059 -1.025 . . . . 0.0 110.607 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -60.29 -26.39 66.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.154 -0.966 . . . . 0.0 110.505 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.503 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 29.1 t -69.94 -54.01 15.27 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.285 -0.885 . . . . 0.0 110.843 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 42.2 mt -59.19 -53.19 61.13 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.048 -1.033 . . . . 0.0 110.566 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.437 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -46.63 -25.63 0.75 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.422 -0.799 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.503 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 39.1 t80 -64.85 -39.95 94.37 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.968 -1.082 . . . . 0.0 110.514 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.26 -23.76 60.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.514 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.531 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.3 m-30 -66.42 -27.94 68.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.167 -0.958 . . . . 0.0 110.346 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mmtt -63.58 -42.46 98.31 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.238 -0.914 . . . . 0.0 110.151 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 mmtm -75.12 -40.35 59.92 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.323 -0.861 . . . . 0.0 110.353 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 41.5 m-70 -94.91 39.63 1.1 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.228 -0.92 . . . . 0.0 110.446 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.469 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 10.1 p -57.5 -14.69 5.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.267 -0.896 . . . . 0.0 110.593 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.8 p -96.77 3.97 52.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.972 . . . . 0.0 110.403 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mp -92.28 -22.89 19.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.234 -0.916 . . . . 0.0 110.434 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.469 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 37.4 p90 -130.06 -177.1 4.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.191 -0.943 . . . . 0.0 109.799 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.9 m -95.67 -64.23 1.08 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.016 -1.052 . . . . 0.0 110.333 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.52 145.5 18.97 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.785 -1.197 . . . . 0.0 109.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.44 HG11 ' O ' ' A' ' 31' ' ' VAL . 7.4 p -91.77 102.6 13.69 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.634 -0.666 . . . . 0.0 110.418 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.454 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 2.6 p -52.35 154.52 2.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.08 -1.013 . . . . 0.0 109.598 179.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 p -60.56 158.77 11.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.146 -0.971 . . . . 0.0 110.07 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -67.54 126.25 28.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.142 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.502 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 32.7 p-90 -146.24 173.27 12.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.987 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.502 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 4.9 t60 -162.72 -178.26 6.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.125 -0.984 . . . . 0.0 110.687 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.433 ' H ' ' CG ' ' A' ' 36' ' ' HIS . 48.8 m95 -79.37 92.37 5.18 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.469 -0.769 . . . . 0.0 110.158 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.404 HG22 ' C ' ' A' ' 37' ' ' TRP . 72.6 p . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.291 -0.881 . . . . 0.0 110.399 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.314 0.578 . . . . 0.0 110.52 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.511 HG22 ' N ' ' A' ' 49' ' ' VAL . 58.0 mt -145.92 150.33 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.333 -0.855 . . . . 0.0 110.435 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.511 ' N ' HG22 ' A' ' 48' ' ' ILE . 2.1 t -122.71 170.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 109.805 179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.501 HG23 ' N ' ' A' ' 51' ' ' LEU . 60.9 m -145.76 156.58 43.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.065 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.501 ' N ' HG23 ' A' ' 50' ' ' THR . 2.2 mp -136.24 133.11 36.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.223 -0.923 . . . . 0.0 110.31 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.509 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 18.5 m -96.81 130.57 44.05 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.361 -0.837 . . . . 0.0 110.219 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.542 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 11.7 m-85 -110.43 147.99 32.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.178 -0.951 . . . . 0.0 109.987 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -78.9 -3.42 44.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.145 -0.972 . . . . 0.0 110.669 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.49 139.65 1.67 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -56.63 -31.93 64.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.907 . . . . 0.0 109.785 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -55.05 -59.74 4.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.606 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -57.31 -36.76 71.5 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.913 . . . . 0.0 111.152 -178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 ttp85 -59.26 -40.98 87.74 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.984 -1.072 . . . . 0.0 110.512 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.54 -40.91 96.37 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.273 -0.892 . . . . 0.0 110.745 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -65.66 -40.35 92.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.121 -0.987 . . . . 0.0 110.537 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.405 ' CE2' HG21 ' A' ' 66' ' ' VAL . 9.4 t80 -55.45 -45.5 76.83 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.153 -0.967 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.55 -16.56 25.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.38 -0.825 . . . . 0.0 110.382 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -22.73 19.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.12 -0.987 . . . . 0.0 110.309 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -95.51 -26.52 15.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.038 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 68' ' ' ILE . 87.0 t -107.09 75.07 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.874 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.78 104.68 0.47 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.197 -0.94 . . . . 0.0 109.886 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 66' ' ' VAL . 0.8 OUTLIER -88.51 134.92 33.26 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.278 -0.889 . . . . 0.0 109.701 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.482 ' O ' ' O ' ' A' ' 68' ' ' ILE . 44.4 Cg_endo -54.77 -160.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.172 1.617 . . . . 0.0 110.561 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 tttm -95.47 2.98 54.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.907 -179.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.46 ' OG1' HG22 ' A' ' 13' ' ' THR . 4.5 p -85.24 -28.59 25.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.076 -1.015 . . . . 0.0 110.774 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.477 ' HB ' ' CG2' ' A' ' 68' ' ' ILE . 12.8 mm -94.21 124.57 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.479 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 6.4 t -96.34 138.3 34.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.361 -0.837 . . . . 0.0 110.011 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.01 165.81 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.083 -1.011 . . . . 0.0 111.103 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.486 ' HB2' ' O ' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.23 155.43 45.26 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 110.524 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.6 p -133.67 134.15 42.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.288 -0.882 . . . . 0.0 110.339 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.49 -169.38 25.79 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.599 -1.401 . . . . 0.0 109.599 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.583 ' CE2' ' HB2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -148.07 150.86 34.66 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.378 -1.072 . . . . 0.0 110.165 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 26.6 mtp -122.72 158.24 30.56 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.479 ' O ' HG13 ' A' ' 81' ' ' ILE . 0.2 OUTLIER -144.42 111.89 6.06 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 110.114 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 80' ' ' SER . 3.1 mp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.144 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.585 ' HB2' ' CE2' ' B' ' 78' ' ' PHE . 1.7 mtp . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.194 0.521 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 17.6 p -98.52 122.55 53.12 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 0.0 110.678 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.514 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 46.4 Cg_endo -80.69 163.88 21.0 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 123.982 1.517 . . . . 0.0 109.949 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.511 HG23 ' O ' ' B' ' 3' ' ' PRO . 4.9 pt -142.94 123.68 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.108 -0.995 . . . . 0.0 110.813 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.423 ' O ' ' CG1' ' B' ' 5' ' ' VAL . 11.5 p -94.78 124.94 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 110.319 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.5 ' O ' ' HB2' ' B' ' 75' ' ' SER . 0.0 OUTLIER -107.07 127.16 53.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.197 -0.939 . . . . 0.0 110.192 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.476 ' HA ' ' O ' ' B' ' 73' ' ' THR . 0.7 OUTLIER -129.11 153.31 47.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.048 -1.032 . . . . 0.0 110.457 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.48 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 1.2 ttpm? -142.05 169.95 16.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.285 -0.885 . . . . 0.0 110.192 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.48 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.04 -175.27 31.6 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.09 146.01 55.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.29 -1.124 . . . . 0.0 110.583 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.17 -47.05 54.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.389 -0.819 . . . . 0.0 110.631 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . 0.448 ' OD1' ' N ' ' B' ' 12' ' ' ASN . 3.1 m120 -56.05 -48.32 76.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.13 -0.981 . . . . 0.0 110.649 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.476 HG22 ' OG1' ' B' ' 71' ' ' THR . 0.2 OUTLIER -58.15 -21.28 46.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.221 -0.924 . . . . 0.0 110.69 -179.563 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 54.5 mt -74.63 -39.81 61.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.99 -1.069 . . . . 0.0 110.647 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.48 -26.17 66.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.144 -0.973 . . . . 0.0 110.619 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.511 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 29.4 t -69.81 -53.77 16.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 110.768 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.23 -53.55 56.95 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.16 -0.962 . . . . 0.0 110.616 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 0.3 OUTLIER -46.47 -25.51 0.69 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.315 -0.865 . . . . 0.0 111.154 -179.358 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.511 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 40.1 t80 -64.9 -40.35 94.95 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.004 -1.06 . . . . 0.0 110.458 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.18 -23.53 60.44 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.141 -0.975 . . . . 0.0 110.584 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.535 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 10.2 m-30 -66.37 -28.05 68.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.147 -0.971 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 mmtt -63.62 -42.21 98.21 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 110.185 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -75.18 -40.41 59.44 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 110.313 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -95.05 39.78 1.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.192 -0.943 . . . . 0.0 110.405 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.473 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 9.4 p -57.62 -14.83 5.97 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.335 -0.853 . . . . 0.0 110.361 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 29.9 p -96.65 3.91 52.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.219 -0.925 . . . . 0.0 110.303 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 mp -92.25 -23.17 19.41 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.236 -0.915 . . . . 0.0 110.364 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.473 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 39.9 p90 -129.6 -177.0 4.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.203 -0.936 . . . . 0.0 109.783 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -95.33 -64.55 1.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.065 -1.022 . . . . 0.0 110.294 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.58 145.2 18.67 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 120.905 -1.122 . . . . 0.0 109.004 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.429 HG11 ' O ' ' B' ' 31' ' ' VAL . 7.7 p -91.77 102.66 13.75 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.74 -0.6 . . . . 0.0 110.471 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.462 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 2.6 p -51.87 154.2 2.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.053 -1.029 . . . . 0.0 109.835 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 2.9 p -60.76 158.82 12.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.015 -1.053 . . . . 0.0 109.898 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.71 126.63 30.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.491 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 33.4 p-90 -146.45 173.2 12.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.26 -0.9 . . . . 0.0 110.022 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.491 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 5.0 t60 -162.66 -178.45 6.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.149 -0.97 . . . . 0.0 110.655 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.509 ' CH2' ' OG1' ' A' ' 52' ' ' THR . 55.0 m95 -79.33 92.97 5.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.444 -0.785 . . . . 0.0 110.076 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' THR . . . . . 0.41 HG22 ' C ' ' B' ' 37' ' ' TRP . 70.7 p . . . . . 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 110.256 -179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.291 0.567 . . . . 0.0 110.586 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.505 HG22 ' N ' ' B' ' 49' ' ' VAL . 56.4 mt -145.99 150.05 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.348 -0.845 . . . . 0.0 110.376 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . 0.505 ' N ' HG22 ' B' ' 48' ' ' ILE . 2.1 t -122.79 170.13 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.216 -0.927 . . . . 0.0 109.857 179.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.492 HG23 ' N ' ' B' ' 51' ' ' LEU . 73.3 m -145.46 156.53 43.8 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.158 -0.964 . . . . 0.0 110.14 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.492 ' N ' HG23 ' B' ' 50' ' ' THR . 2.3 mp -136.23 133.65 37.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.889 . . . . 0.0 110.197 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 19.8 m -96.97 130.65 44.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.313 -0.867 . . . . 0.0 110.192 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.526 ' N ' ' CD1' ' B' ' 53' ' ' TYR . 16.3 m-85 -110.06 147.53 33.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.176 -0.953 . . . . 0.0 110.03 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -78.9 -2.95 42.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.727 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.52 139.04 1.21 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.151 -0.968 . . . . 0.0 110.162 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -56.22 -32.31 64.31 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.284 -0.885 . . . . 0.0 109.809 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 17.1 t-105 -54.7 -59.81 4.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 110.612 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.16 -36.73 71.11 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 111.065 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 48.5 ttp85 -59.16 -41.12 87.62 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.937 -1.102 . . . . 0.0 110.627 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.28 -41.25 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.117 -0.99 . . . . 0.0 110.672 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -65.46 -39.78 92.43 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.165 -0.959 . . . . 0.0 110.56 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -55.59 -45.96 77.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.141 -0.974 . . . . 0.0 109.624 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.4 mt -59.72 -15.07 17.13 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.453 -0.78 . . . . 0.0 110.459 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -22.95 18.09 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.068 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -95.02 -26.6 16.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.267 -0.896 . . . . 0.0 109.886 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.507 ' O ' HG13 ' B' ' 68' ' ' ILE . 89.8 t -107.17 75.55 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.229 -0.919 . . . . 0.0 110.106 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 104.79 0.51 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.186 -0.946 . . . . 0.0 109.936 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.507 HG13 ' O ' ' B' ' 66' ' ' VAL . 0.8 OUTLIER -88.62 135.1 32.79 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.287 -0.883 . . . . 0.0 109.834 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.478 ' O ' ' O ' ' B' ' 68' ' ' ILE . 43.7 Cg_endo -54.76 -160.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.052 1.554 . . . . 0.0 110.706 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' B' ' 70' ' ' LYS . 29.7 tttm -94.66 2.6 55.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.193 -0.942 . . . . 0.0 110.837 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' THR . . . . . 0.476 ' OG1' HG22 ' B' ' 13' ' ' THR . 4.6 p -85.32 -28.64 25.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.12 -0.988 . . . . 0.0 110.972 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.487 ' HB ' ' CG2' ' B' ' 68' ' ' ILE . 12.8 mm -94.32 124.36 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.143 -0.973 . . . . 0.0 111.035 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.3 t -96.18 138.54 33.64 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.001 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -89.87 166.25 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.067 -1.021 . . . . 0.0 111.053 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -142.67 155.29 44.89 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.647 -0.658 . . . . 0.0 110.427 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.2 p -133.3 134.26 43.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.07 -170.14 26.4 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.585 ' CE2' ' HB2' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.86 150.24 33.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.234 -1.156 . . . . 0.0 110.129 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.403 ' O ' ' HB3' ' B' ' 1' ' ' MET . 24.5 mtp -122.18 157.76 30.86 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.901 . . . . 0.0 110.344 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.485 ' O ' HG13 ' B' ' 81' ' ' ILE . 0.2 OUTLIER -144.41 112.21 6.23 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.26 -0.9 . . . . 0.0 109.921 179.812 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.485 HG13 ' O ' ' B' ' 80' ' ' SER . 3.0 mp . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.122 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.207 0.527 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.9 p -125.11 109.85 27.15 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.296 -0.877 . . . . 0.0 110.106 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.457 ' O ' HG23 ' A' ' 4' ' ' ILE . 44.4 Cg_endo -50.75 149.48 14.09 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.003 1.528 . . . . 0.0 110.364 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 77' ' ' GLY . 1.0 OUTLIER -143.49 175.84 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.786 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.498 HG11 HG13 ' A' ' 74' ' ' VAL . 78.4 t -145.68 121.11 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.173 -0.955 . . . . 0.0 110.168 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.575 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 0.0 OUTLIER -105.39 125.72 51.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.243 -0.911 . . . . 0.0 110.333 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.47 ' HG ' HG13 ' A' ' 74' ' ' VAL . 3.3 mp -117.65 141.38 48.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.275 -0.89 . . . . 0.0 110.072 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.536 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 20.5 tptp -139.09 160.44 39.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.968 . . . . 0.0 110.455 -179.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.536 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 156.75 -156.76 27.43 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . 0.471 ' OD1' ' HB2' ' A' ' 12' ' ' ASN . 6.9 t70 -65.14 124.93 23.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.306 -1.114 . . . . 0.0 110.452 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.16 -36.09 28.77 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.261 -0.9 . . . . 0.0 110.388 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.471 ' HB2' ' OD1' ' A' ' 10' ' ' ASP . 3.9 m-20 -69.2 -46.83 66.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.162 -0.961 . . . . 0.0 110.682 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.9 m -57.69 -24.05 54.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.148 -0.97 . . . . 0.0 110.298 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.461 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 51.9 mt -69.06 -32.36 71.76 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.415 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -59.59 -38.24 80.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 110.373 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.8 t -70.08 -36.64 75.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.158 -0.964 . . . . 0.0 110.506 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 31.6 mt -58.6 -50.9 72.13 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.239 -0.913 . . . . 0.0 110.308 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.559 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 11.0 ttm180 -46.4 -27.21 1.0 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.147 -0.971 . . . . 0.0 110.548 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.456 ' C ' ' CD1' ' A' ' 19' ' ' TYR . 9.5 t80 -64.93 -42.08 94.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.141 -0.974 . . . . 0.0 110.612 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.55 ' O ' ' CD2' ' A' ' 24' ' ' HIS . 74.1 mtt180 -72.13 -22.4 61.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.086 -1.009 . . . . 0.0 110.447 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.559 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 12.8 m-30 -66.58 -9.85 39.52 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.131 -0.981 . . . . 0.0 110.275 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -63.59 -50.92 67.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.257 -0.902 . . . . 0.0 110.536 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -75.14 -14.75 60.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.121 -0.987 . . . . 0.0 110.313 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.565 ' N ' ' CD2' ' A' ' 24' ' ' HIS . 7.1 m-70 -94.92 19.89 9.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.183 -0.948 . . . . 0.0 110.221 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.473 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 24.5 p -56.83 -24.76 53.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 0.0 110.052 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.5 t -97.08 3.48 51.75 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 110.161 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.502 HD13 ' CG ' ' A' ' 24' ' ' HIS . 23.9 mt -92.13 -32.49 15.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.507 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.473 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 50.8 p90 -117.6 167.53 11.24 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.039 -1.038 . . . . 0.0 109.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.8 m -100.26 -31.09 11.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.185 -0.947 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.93 117.03 2.56 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.104 -0.998 . . . . 0.0 110.792 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 31' ' ' VAL . 3.0 p -89.04 114.71 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.211 -0.931 . . . . 0.0 110.146 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.568 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 88.5 p -68.18 143.31 55.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.467 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 2.2 p -61.41 162.06 8.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.284 -0.885 . . . . 0.0 110.128 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.3 m -67.96 134.57 50.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.224 -0.922 . . . . 0.0 110.098 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.534 ' O ' ' N ' ' A' ' 48' ' ' ILE . 41.9 p-90 -146.52 -179.21 6.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.141 -0.975 . . . . 0.0 109.921 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.607 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 46.1 t60 -162.52 174.32 12.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.992 . . . . 0.0 110.417 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.607 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 89.0 m95 -78.43 105.39 9.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.87 . . . . 0.0 110.185 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.41 -0.806 . . . . 0.0 110.109 -179.927 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.438 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.378 0.609 . . . . 0.0 110.509 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' A' ' 35' ' ' TRP . 45.5 mt -142.93 134.3 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.364 -0.835 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 62.0 t -106.92 161.2 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.575 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 22.4 m -145.82 160.15 42.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.296 -0.877 . . . . 0.0 109.885 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.2 134.85 38.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.178 -0.951 . . . . 0.0 110.266 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.24 128.35 43.08 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 110.423 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.449 ' OH ' ' CD2' ' A' ' 62' ' ' PHE . 61.5 m-85 -118.42 151.01 38.59 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.308 -0.87 . . . . 0.0 110.228 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -103.72 -16.67 15.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.217 -0.927 . . . . 0.0 110.341 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.3 m -128.61 131.53 48.13 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 0.0 110.125 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -57.44 -50.04 74.31 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.237 -0.915 . . . . 0.0 110.347 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.65 -43.71 69.02 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.187 -0.945 . . . . 0.0 110.429 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -57.79 -44.91 86.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.313 -0.867 . . . . 0.0 110.589 -179.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.408 ' HD2' ' CG2' ' A' ' 5' ' ' VAL . 4.9 ttt-85 -58.79 -40.45 84.06 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.041 -1.037 . . . . 0.0 110.039 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -61.42 -36.18 79.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.489 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 61.9 mt-30 -65.64 -44.85 85.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.297 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.578 ' CZ ' HG13 ' A' ' 66' ' ' VAL . 4.2 t80 -55.75 -46.16 77.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.279 -0.888 . . . . 0.0 110.598 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.44 -23.0 62.31 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.927 . . . . 0.0 110.747 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 59.9 p -93.01 -19.87 21.15 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.074 -1.017 . . . . 0.0 110.619 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 27.9 mt-30 -95.83 -8.6 33.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.154 -0.966 . . . . 0.0 110.173 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.578 HG13 ' CZ ' ' A' ' 62' ' ' PHE . 16.9 m -111.82 108.57 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 0.0 110.047 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -65.61 107.79 1.84 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 110.243 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.493 HG22 ' HD2' ' A' ' 69' ' ' PRO . 16.2 mm -88.96 128.36 52.33 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.218 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.55 ' CG ' ' CD1' ' A' ' 72' ' ' ILE . 43.4 Cg_endo -58.83 -155.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.948 1.499 . . . . 0.0 110.366 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . 0.498 ' O ' ' HD3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -111.02 40.76 1.96 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -0.972 . . . . 0.0 110.554 -179.729 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.74 -15.64 0.12 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.266 -0.896 . . . . 0.0 111.663 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.55 ' CD1' ' CG ' ' A' ' 69' ' ' PRO . 19.1 mt -94.95 103.44 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 120.693 -1.255 . . . . 0.0 110.037 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.49 HG21 ' N ' ' A' ' 74' ' ' VAL . 61.6 m -95.85 163.9 12.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.289 -0.882 . . . . 0.0 109.969 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.498 HG13 HG11 ' A' ' 5' ' ' VAL . 21.3 t -143.11 130.09 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.056 -1.028 . . . . 0.0 111.651 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 177.43 4.9 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.293 0.568 . . . . 0.0 110.089 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.406 ' O ' ' O ' ' B' ' 80' ' ' SER . 0.7 OUTLIER -111.84 152.97 27.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.176 -0.952 . . . . 0.0 110.252 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.461 ' O ' HG13 ' A' ' 4' ' ' ILE . . . -158.87 168.7 35.04 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' B' ' 78' ' ' PHE . 70.9 m-85 -147.71 124.82 11.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.142 -1.211 . . . . 0.0 110.174 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.477 ' HE3' ' CE1' ' B' ' 6' ' ' HIS . 0.0 OUTLIER -98.3 174.24 6.59 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.223 -0.923 . . . . 0.0 110.384 -179.866 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.486 ' O ' ' O ' ' B' ' 76' ' ' THR . 0.0 OUTLIER -144.21 106.34 4.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.28 -0.888 . . . . 0.0 110.105 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.435 ' CG2' ' C ' ' A' ' 80' ' ' SER . 10.7 pt . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.266 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.185 0.517 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 24.4 p -125.74 108.59 25.65 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.178 -0.951 . . . . 0.0 110.323 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.459 ' O ' HG23 ' B' ' 4' ' ' ILE . 47.3 Cg_endo -49.3 150.04 8.33 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.06 1.558 . . . . 0.0 110.533 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.459 HG23 ' O ' ' B' ' 3' ' ' PRO . 1.0 OUTLIER -143.88 176.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 0.0 110.391 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.501 HG11 HG13 ' B' ' 74' ' ' VAL . 77.6 t -145.89 120.91 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.245 -0.909 . . . . 0.0 110.1 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.574 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 0.0 OUTLIER -105.59 125.54 51.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.475 HD21 HG21 ' B' ' 74' ' ' VAL . 3.1 mp -117.34 141.43 48.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.327 -0.858 . . . . 0.0 110.194 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.533 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 20.8 tptp -139.13 160.02 40.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.139 -0.976 . . . . 0.0 110.45 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.533 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 156.88 -156.6 27.31 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . 0.442 ' OD1' ' HB2' ' B' ' 12' ' ' ASN . 5.4 t70 -65.15 125.01 23.66 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.29 -1.124 . . . . 0.0 110.423 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.14 -36.8 31.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 110.47 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . 0.442 ' HB2' ' OD1' ' B' ' 10' ' ' ASP . 3.7 m-20 -68.35 -47.32 67.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.702 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 63.1 m -57.79 -23.04 50.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.151 -0.968 . . . . 0.0 110.247 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.445 ' HA ' ' CD1' ' B' ' 17' ' ' LEU . 53.9 mt -69.65 -32.11 70.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.289 -0.882 . . . . 0.0 110.285 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -59.72 -38.75 82.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.249 -0.907 . . . . 0.0 110.419 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.414 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 6.8 t -70.04 -36.64 75.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.927 . . . . 0.0 110.459 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.445 ' CD1' ' HA ' ' B' ' 14' ' ' LEU . 30.2 mt -58.59 -50.7 72.86 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.134 -0.978 . . . . 0.0 110.3 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.552 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 10.9 ttm180 -46.5 -27.13 1.01 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.401 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.463 ' C ' ' CD1' ' B' ' 19' ' ' TYR . 9.1 t80 -64.99 -42.35 94.59 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.188 -0.945 . . . . 0.0 110.694 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . 0.549 ' O ' ' CD2' ' B' ' 24' ' ' HIS . 74.8 mtt180 -71.58 -22.63 61.71 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.165 -0.959 . . . . 0.0 110.402 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.552 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 12.7 m-30 -66.44 -9.9 38.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.142 -0.974 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.67 -50.87 67.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.237 -0.914 . . . . 0.0 110.434 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -75.07 -14.66 60.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.201 -0.937 . . . . 0.0 110.235 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.556 ' CD2' ' N ' ' B' ' 24' ' ' HIS . 7.8 m-70 -94.92 19.75 9.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.973 . . . . 0.0 110.186 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.469 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 25.4 p -57.08 -25.07 58.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 3.4 t -96.84 3.37 52.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.265 -0.897 . . . . 0.0 110.001 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.47 HD13 ' CG ' ' B' ' 24' ' ' HIS . 23.9 mt -92.03 -32.61 15.13 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.288 -0.883 . . . . 0.0 110.501 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.469 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 50.6 p90 -117.64 167.17 11.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.004 -1.06 . . . . 0.0 110.129 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.9 m -100.07 -31.06 11.61 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 110.665 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 116.88 2.55 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.006 -1.059 . . . . 0.0 110.744 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.485 HG12 ' O ' ' B' ' 31' ' ' VAL . 3.1 p -89.1 112.88 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.182 -0.949 . . . . 0.0 110.073 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.503 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 91.1 p -66.43 142.95 57.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.367 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 1.5 p -61.32 162.11 8.19 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 89.6 m -68.0 134.81 51.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 110.207 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.568 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 41.1 p-90 -146.36 -179.15 6.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.913 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.614 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 46.0 t60 -162.53 174.41 12.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.128 -0.982 . . . . 0.0 110.427 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.614 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 88.1 m95 -78.65 104.94 9.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.336 -0.853 . . . . 0.0 110.294 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 44.5 m . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.431 -0.793 . . . . 0.0 109.943 -179.914 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.439 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 121.363 0.601 . . . . 0.0 110.645 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.519 ' N ' ' O ' ' B' ' 35' ' ' TRP . 45.4 mt -142.59 134.85 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.289 -0.882 . . . . 0.0 110.025 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.64 161.22 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.157 -0.964 . . . . 0.0 110.522 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.574 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 23.6 m -145.88 160.32 41.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.805 . . . . 0.0 109.908 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.36 134.96 38.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.162 -0.962 . . . . 0.0 110.335 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 127.29 42.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.235 -0.915 . . . . 0.0 110.255 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.468 ' OH ' ' CD2' ' B' ' 62' ' ' PHE . 61.0 m-85 -117.11 150.81 38.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.349 -0.844 . . . . 0.0 109.982 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -103.49 -16.72 15.48 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 19.4 m -128.43 132.42 48.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.181 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -58.19 -49.89 75.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.885 . . . . 0.0 110.252 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.76 -43.52 69.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.342 -0.849 . . . . 0.0 110.527 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -57.85 -45.29 86.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.319 -0.863 . . . . 0.0 110.612 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.451 ' HD2' ' CG2' ' B' ' 5' ' ' VAL . 4.7 ttt-85 -58.83 -40.86 85.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.091 -1.005 . . . . 0.0 110.119 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -61.12 -35.79 77.99 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.862 . . . . 0.0 110.301 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.476 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 60.3 mt-30 -65.61 -45.21 84.0 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.243 -0.91 . . . . 0.0 110.391 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.577 ' CZ ' HG13 ' B' ' 66' ' ' VAL . 4.4 t80 -55.53 -46.2 77.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.314 -0.866 . . . . 0.0 110.703 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.57 -22.03 61.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.233 -0.917 . . . . 0.0 110.693 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 58.9 p -93.92 -19.82 20.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.247 -0.908 . . . . 0.0 110.574 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 30.0 mt-30 -95.82 -9.58 31.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.21 -0.931 . . . . 0.0 110.066 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.577 HG13 ' CZ ' ' B' ' 62' ' ' PHE . 16.8 m -110.75 109.02 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.865 . . . . 0.0 110.155 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -66.31 107.96 2.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.347 -0.846 . . . . 0.0 110.266 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.483 HG22 ' HD2' ' B' ' 69' ' ' PRO . 17.1 mm -89.1 127.45 55.45 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.41 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.557 ' CG ' ' CD1' ' B' ' 72' ' ' ILE . 43.5 Cg_endo -57.46 -155.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 124.054 1.555 . . . . 0.0 110.442 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . 0.496 ' O ' ' HD3' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -112.15 40.84 2.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.025 -1.047 . . . . 0.0 110.458 -179.775 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.63 -15.7 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.295 -0.878 . . . . 0.0 111.616 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.557 ' CD1' ' CG ' ' B' ' 69' ' ' PRO . 20.7 mt -94.98 102.95 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 120.934 -1.104 . . . . 0.0 109.898 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' THR . . . . . 0.466 HG21 ' N ' ' B' ' 74' ' ' VAL . 66.0 m -95.45 163.71 13.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.883 . . . . 0.0 110.083 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.501 HG13 HG11 ' B' ' 5' ' ' VAL . 21.5 t -142.88 130.64 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.05 -1.031 . . . . 0.0 111.615 -178.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.97 178.7 4.54 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.144 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.7 OUTLIER -113.75 151.07 32.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 179.81 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . 0.454 ' O ' HG13 ' B' ' 4' ' ' ILE . . . -157.23 169.7 34.32 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' A' ' 78' ' ' PHE . 69.4 m-85 -147.85 126.57 12.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -1.153 . . . . 0.0 110.136 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.556 ' HE3' ' CE1' ' A' ' 6' ' ' HIS . 0.0 OUTLIER -100.57 172.59 7.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.093 -1.005 . . . . 0.0 110.297 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.435 ' C ' ' CG2' ' B' ' 81' ' ' ILE . 0.1 OUTLIER -142.48 107.06 4.82 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.897 . . . . 0.0 109.875 179.86 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.435 ' CG2' ' C ' ' B' ' 80' ' ' SER . 10.5 pt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.284 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.478 ' HB2' ' CE2' ' A' ' 78' ' ' PHE . 23.9 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' THR . . . . . 0.408 HG23 ' O ' ' A' ' 53' ' ' TYR . 52.1 m -128.04 133.17 24.84 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.294 -0.879 . . . . 0.0 109.913 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -81.5 161.7 19.51 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.925 1.487 . . . . 0.0 110.319 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.431 HG23 ' CG2' ' A' ' 52' ' ' THR . 6.5 pt -144.05 163.63 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.093 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.8 t -145.75 129.84 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.573 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.2 OUTLIER -105.37 137.0 43.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.267 -0.895 . . . . 0.0 110.374 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.482 ' O ' HG21 ' A' ' 48' ' ' ILE . 3.4 pp -125.38 142.78 51.31 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.343 -0.848 . . . . 0.0 109.826 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.514 ' O ' ' CD1' ' A' ' 72' ' ' ILE . 21.6 tptt -136.18 154.82 50.84 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.054 -1.028 . . . . 0.0 110.833 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.477 ' HA3' HD13 ' A' ' 72' ' ' ILE . . . 161.89 -178.74 37.63 Favored Glycine 0 N--CA 1.486 1.985 0 N-CA-C 108.455 -1.858 . . . . 0.0 108.455 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.56 150.47 48.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.976 -1.308 . . . . 0.0 111.07 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.83 -52.18 43.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.143 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -48.82 -45.55 40.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.11 -0.994 . . . . 0.0 110.16 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.2 m -58.03 -20.89 42.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.33 -0.856 . . . . 0.0 110.203 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 16.5 mt -83.93 -32.32 25.15 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.235 -0.915 . . . . 0.0 110.302 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -60.91 -37.04 80.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.075 -1.016 . . . . 0.0 110.488 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -47.77 59.27 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.268 -0.895 . . . . 0.0 111.384 -179.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.0 mt -58.44 -52.38 65.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.072 -1.017 . . . . 0.0 110.539 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 -45.66 -33.94 3.2 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -64.73 -13.13 53.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.233 -0.917 . . . . 0.0 110.163 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.22 -33.2 10.53 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.244 -0.91 . . . . 0.0 110.241 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.561 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 8.7 m-30 -66.59 -33.63 76.1 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.48 -44.83 93.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 110.383 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -75.03 -32.63 61.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.187 -0.946 . . . . 0.0 110.249 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.606 ' O ' ' N ' ' A' ' 26' ' ' THR . 28.6 m170 -95.78 34.65 1.48 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.322 -0.861 . . . . 0.0 110.34 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.576 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 13.2 p -59.6 43.53 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.435 -0.791 . . . . 0.0 112.011 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' THR . . . . . 0.606 ' N ' ' O ' ' A' ' 24' ' ' HIS . 75.3 p -144.72 33.29 1.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.768 -1.208 . . . . 0.0 109.663 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 78.6 mt -146.31 -5.79 0.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.183 -0.948 . . . . 0.0 111.448 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.576 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 10.5 p90 -126.13 162.38 25.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.686 -1.259 . . . . 0.0 108.912 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.483 ' HB ' ' O ' ' A' ' 52' ' ' THR . 6.6 m -101.81 -38.74 7.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.641 -1.287 . . . . 0.0 111.34 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.01 120.08 2.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.881 -1.137 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.442 ' O ' HG22 ' B' ' 38' ' ' THR . 3.2 p -88.97 105.65 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.281 -0.887 . . . . 0.0 109.893 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.582 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 54.7 p -64.35 152.87 40.14 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.528 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.46 155.56 21.49 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.278 -0.888 . . . . 0.0 110.109 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' THR . . . . . 0.429 ' HA ' HG22 ' A' ' 49' ' ' VAL . 31.9 m -68.05 129.18 39.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.223 -0.923 . . . . 0.0 110.546 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 50.5 p-90 -147.13 179.92 7.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.207 -0.933 . . . . 0.0 110.125 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.539 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 36.2 t-80 -162.57 173.27 14.19 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.977 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.539 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 98.1 m95 -79.07 126.0 30.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.13 -0.981 . . . . 0.0 109.928 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.4 t . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.766 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.325 0.583 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.522 ' N ' ' O ' ' A' ' 35' ' ' TRP . 68.7 mt -142.8 155.99 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.406 -0.809 . . . . 0.0 109.854 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.512 ' N ' HG23 ' A' ' 48' ' ' ILE . 87.2 t -136.24 129.79 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.144 -0.972 . . . . 0.0 110.524 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.493 ' OG1' ' NE2' ' A' ' 6' ' ' HIS . 86.5 m -93.94 150.06 20.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.071 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -135.05 121.18 20.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.103 -0.998 . . . . 0.0 110.055 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.483 ' O ' ' HB ' ' A' ' 29' ' ' THR . 0.0 OUTLIER -99.0 144.26 28.36 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 110.408 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.509 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 26.4 m-85 -124.08 156.73 36.07 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 109.839 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -83.67 -6.03 59.34 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.149 -0.97 . . . . 0.0 110.682 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.1 m -163.98 156.4 17.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.092 -1.005 . . . . 0.0 110.408 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.403 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 62.9 mt-10 -68.62 -41.25 79.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.258 -0.901 . . . . 0.0 110.28 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.411 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 6.0 t90 -53.64 -52.75 58.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.179 -0.95 . . . . 0.0 109.982 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.461 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 48.1 tt0 -58.98 -32.86 70.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.384 -0.823 . . . . 0.0 110.253 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.403 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 3.6 ttm180 -59.02 -54.52 46.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.302 -0.874 . . . . 0.0 110.621 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -61.04 -25.87 67.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.193 -0.942 . . . . 0.0 110.32 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 68.4 mt-30 -65.63 -54.36 28.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.159 -0.963 . . . . 0.0 110.308 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.482 ' CE2' HG22 ' A' ' 66' ' ' VAL . 7.2 t80 -55.76 -46.75 77.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.343 -0.848 . . . . 0.0 110.456 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.4 mt -59.14 -20.64 55.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.281 -0.887 . . . . 0.0 110.343 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.44 -22.54 19.56 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.904 . . . . 0.0 110.289 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -96.41 -21.56 17.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.2 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.482 HG22 ' CE2' ' A' ' 62' ' ' PHE . 59.9 t -97.55 105.55 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.47 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . 0.422 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.7 OUTLIER -58.26 103.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.899 179.664 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.439 HG23 ' CG2' ' A' ' 72' ' ' ILE . 40.6 mt -88.9 99.51 1.57 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 110.094 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.406 ' HG2' HG12 ' A' ' 72' ' ' ILE . 46.8 Cg_endo -45.13 159.41 0.15 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.069 1.563 . . . . 0.0 110.36 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -63.82 -13.68 46.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.5 p -84.62 -21.11 30.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.268 -0.895 . . . . 0.0 110.195 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.514 ' CD1' ' O ' ' A' ' 8' ' ' LYS . 6.8 mm -94.24 113.47 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.0 110.183 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.5 m -94.35 145.06 25.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.252 -0.905 . . . . 0.0 110.174 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.51 171.8 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.204 -0.935 . . . . 0.0 110.921 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' SER . . . . . 0.573 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.6 OUTLIER -142.68 154.65 44.52 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.576 -0.703 . . . . 0.0 110.496 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 60.4 p -131.77 134.89 46.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.174 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.34 -170.7 34.2 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' B' ' 78' ' ' PHE . 0.0 OUTLIER -147.71 143.91 27.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.362 -1.081 . . . . 0.0 110.033 -179.934 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.2 mmm -135.89 155.42 50.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.779 -1.201 . . . . 0.0 110.649 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.81 108.56 5.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 0.0 110.065 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.3 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.216 -179.972 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.492 ' HB2' ' CE2' ' B' ' 78' ' ' PHE . 22.5 mtp . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.205 0.526 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 2' ' ' THR . . . . . 0.441 HG23 ' O ' ' B' ' 53' ' ' TYR . 58.8 m -127.31 133.84 25.51 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.382 -0.824 . . . . 0.0 110.154 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.507 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -82.19 161.2 17.82 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.918 1.483 . . . . 0.0 110.287 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.413 HG23 ' CG2' ' B' ' 52' ' ' THR . 6.4 pt -143.99 163.36 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.242 -0.911 . . . . 0.0 110.096 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -145.78 130.89 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.237 -0.915 . . . . 0.0 110.267 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.568 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.2 OUTLIER -106.1 138.91 41.45 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.244 -0.91 . . . . 0.0 110.349 -179.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.475 ' O ' HG21 ' B' ' 48' ' ' ILE . 3.5 pp -127.96 142.9 51.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.195 -0.941 . . . . 0.0 110.299 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.533 ' O ' ' CD1' ' B' ' 72' ' ' ILE . 24.1 tptt -140.21 163.17 33.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.118 -0.989 . . . . 0.0 110.526 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.523 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 166.16 -79.7 0.12 Allowed Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -173.28 150.7 1.92 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.252 -1.146 . . . . 0.0 109.509 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . 0.468 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -49.39 -57.3 7.17 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 110.645 -179.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -50.65 -48.51 58.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.408 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 69.8 m -58.19 -21.99 49.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.171 -0.956 . . . . 0.0 110.484 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 16.3 mt -83.34 -32.83 26.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -0.977 . . . . 0.0 110.603 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 ttmt -60.81 -36.98 80.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.016 -1.053 . . . . 0.0 110.635 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -47.5 61.98 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.232 -0.917 . . . . 0.0 111.181 -179.191 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.3 mt -58.54 -52.7 64.53 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.104 -0.998 . . . . 0.0 110.664 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -45.28 -33.69 2.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.232 -0.917 . . . . 0.0 110.135 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -64.82 -13.64 56.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.269 -0.895 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.48 -33.4 10.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.169 -0.957 . . . . 0.0 110.172 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.1 m-30 -66.49 -33.91 76.74 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.23 -0.919 . . . . 0.0 110.355 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.42 -44.7 93.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.343 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 mmtm -74.97 -32.93 61.81 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.184 -0.947 . . . . 0.0 110.26 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.602 ' O ' ' N ' ' B' ' 26' ' ' THR . 28.8 m170 -95.48 35.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.281 -0.887 . . . . 0.0 110.238 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.586 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.3 p -59.78 43.07 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.467 -0.771 . . . . 0.0 112.139 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' THR . . . . . 0.602 ' N ' ' O ' ' B' ' 24' ' ' HIS . 77.8 p -144.69 33.84 1.15 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.729 -1.232 . . . . 0.0 109.846 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.417 ' HG ' ' C ' ' B' ' 26' ' ' THR . 81.5 mt -146.5 -6.04 0.55 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.237 -0.914 . . . . 0.0 111.375 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.586 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 10.9 p90 -125.42 162.61 24.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.701 -1.249 . . . . 0.0 108.779 178.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' B' ' 52' ' ' THR . 6.9 m -101.77 -39.01 7.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.642 -1.286 . . . . 0.0 111.187 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.97 120.18 2.97 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.059 -1.025 . . . . 0.0 111.185 -179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.414 HG12 ' O ' ' B' ' 31' ' ' VAL . 3.3 p -89.09 105.26 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.006 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.58 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.3 p -64.39 153.05 39.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.252 -0.905 . . . . 0.0 110.557 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.22 155.98 19.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.272 -0.892 . . . . 0.0 110.42 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' THR . . . . . 0.453 ' HA ' HG22 ' B' ' 49' ' ' VAL . 26.8 m -68.17 128.48 36.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.382 -0.824 . . . . 0.0 110.343 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.582 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 49.7 p-90 -146.94 179.51 7.54 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.536 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 36.4 t-80 -162.28 173.3 14.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.081 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.536 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 98.0 m95 -79.18 125.19 29.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 0.0 110.009 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' THR . . . . . 0.442 HG22 ' O ' ' A' ' 31' ' ' VAL . 11.3 t . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.234 -0.916 . . . . 0.0 110.157 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.255 0.55 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.517 ' N ' ' O ' ' B' ' 35' ' ' TRP . 62.8 mt -143.1 156.13 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.32 -0.862 . . . . 0.0 109.987 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . 0.482 ' N ' HG23 ' B' ' 48' ' ' ILE . 76.2 t -136.25 129.84 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 110.537 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.527 ' OG1' ' NE2' ' B' ' 6' ' ' HIS . 87.1 m -94.01 149.78 20.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.367 -0.833 . . . . 0.0 109.873 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -134.69 121.56 20.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.043 -1.036 . . . . 0.0 110.052 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.489 ' O ' ' HB ' ' B' ' 29' ' ' THR . 0.0 OUTLIER -99.22 144.57 28.2 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.313 -0.867 . . . . 0.0 110.607 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.507 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 26.0 m-85 -124.62 157.09 36.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.268 -0.895 . . . . 0.0 109.893 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -84.0 -6.99 59.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.264 -0.898 . . . . 0.0 110.664 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.57 157.81 22.57 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.101 -0.999 . . . . 0.0 110.354 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . 0.401 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 57.9 mt-10 -70.16 -41.11 74.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.234 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . 0.408 ' O ' ' HG3' ' B' ' 61' ' ' GLN . 6.0 t90 -53.56 -52.55 59.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.093 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.453 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 46.5 tt0 -59.28 -32.55 70.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.855 . . . . 0.0 110.233 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 3.7 ttm180 -59.11 -54.38 47.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.228 -0.92 . . . . 0.0 110.448 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.15 -26.07 67.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.217 -0.927 . . . . 0.0 110.324 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.453 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 68.0 mt-30 -65.55 -54.28 30.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.207 -0.933 . . . . 0.0 110.229 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.484 ' C ' ' CD1' ' B' ' 62' ' ' PHE . 7.1 t80 -55.91 -46.69 78.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.318 -0.864 . . . . 0.0 110.518 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.4 mt -59.31 -20.71 56.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.55 -22.3 19.6 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.228 -0.92 . . . . 0.0 110.368 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -96.33 -22.0 17.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.22 -0.925 . . . . 0.0 110.023 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.401 HG22 ' CE2' ' B' ' 62' ' ' PHE . 60.7 t -97.22 107.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.341 -0.849 . . . . 0.0 110.341 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.28 103.22 0.22 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -0.885 . . . . 0.0 109.855 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.461 HG23 ' CG2' ' B' ' 72' ' ' ILE . 40.1 mt -88.68 98.68 1.17 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.244 -0.91 . . . . 0.0 110.264 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.441 ' HG2' HG12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -43.99 159.45 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.998 1.525 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 20.9 mtmt -63.73 -13.84 47.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.22 -0.925 . . . . 0.0 110.263 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.3 p -84.64 -20.94 30.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 0.0 110.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.533 ' CD1' ' O ' ' B' ' 8' ' ' LYS . 6.8 mm -93.75 113.22 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 0.0 110.108 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.1 m -94.3 144.96 25.09 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.305 -0.872 . . . . 0.0 110.091 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.54 171.57 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 110.973 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' SER . . . . . 0.568 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -142.93 154.0 43.63 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.613 -0.68 . . . . 0.0 110.516 179.825 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 60.9 p -131.43 135.72 47.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.293 -0.88 . . . . 0.0 110.146 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.47 -170.89 34.54 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' A' ' 78' ' ' PHE . 0.0 OUTLIER -147.69 143.64 27.77 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.253 -1.145 . . . . 0.0 109.964 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.4 mmm -135.7 155.64 50.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.951 -1.093 . . . . 0.0 110.742 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -142.33 109.27 5.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.383 -0.823 . . . . 0.0 109.982 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.216 -179.907 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.441 ' CE ' ' HB3' ' A' ' 78' ' ' PHE . 3.5 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.297 0.57 . . . . 0.0 110.307 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.39 108.67 61.95 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.275 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 51.9 Cg_endo -68.68 143.3 55.84 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.019 1.536 . . . . 0.0 110.047 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.49 ' O ' HG11 ' A' ' 5' ' ' VAL . 3.0 pt -144.69 164.75 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.142 -0.974 . . . . 0.0 110.778 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.49 HG11 ' O ' ' A' ' 4' ' ' ILE . 17.1 m -144.54 147.05 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.724 . . . . 0.0 109.497 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.568 ' CD2' ' HE3' ' B' ' 79' ' ' MET . 0.3 OUTLIER -105.71 127.91 53.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.047 -1.033 . . . . 0.0 110.687 -179.66 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.479 ' O ' ' CG2' ' A' ' 48' ' ' ILE . 0.2 OUTLIER -116.78 136.0 53.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.519 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 13.4 ttmt -140.12 164.47 29.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.221 -0.924 . . . . 0.0 110.26 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 152.49 -174.95 31.29 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.89 136.9 57.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.25 -1.147 . . . . 0.0 110.088 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.97 -23.31 1.94 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 110.136 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -68.95 -59.84 2.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.22 -0.925 . . . . 0.0 110.304 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.43 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -57.96 -21.67 45.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.324 -0.86 . . . . 0.0 110.21 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 mt -66.8 -45.57 77.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.303 -0.873 . . . . 0.0 110.443 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -59.93 -31.26 69.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.186 -0.947 . . . . 0.0 110.373 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.1 t -69.94 -41.75 74.15 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.237 -0.914 . . . . 0.0 110.545 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 13' ' ' THR . 82.3 mt -58.96 -52.48 65.58 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.118 -0.989 . . . . 0.0 110.435 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 24.3 ttt-85 -48.89 -24.35 1.44 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.299 -0.875 . . . . 0.0 110.525 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.49 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 9.8 t80 -64.54 -40.67 96.03 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.106 -0.996 . . . . 0.0 110.282 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 mtm-85 -76.17 -15.53 60.04 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.173 -0.955 . . . . 0.0 110.029 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.492 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 3.7 m-30 -66.33 -30.9 71.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.251 -0.905 . . . . 0.0 109.836 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -63.31 -33.96 76.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -0.915 . . . . 0.0 109.883 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -74.89 -48.91 22.33 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.85 . . . . 0.0 109.732 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.494 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 54.4 m-70 -95.27 28.51 2.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.333 -0.855 . . . . 0.0 109.761 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.597 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 22.6 p -56.75 -22.02 32.53 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 110.027 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 23.0 p -97.22 10.94 38.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -0.853 . . . . 0.0 109.949 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.494 ' HB2' ' O ' ' A' ' 24' ' ' HIS . 0.7 OUTLIER -92.1 -43.37 9.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.0 110.175 179.903 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.597 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 19.8 p90 -96.41 175.72 6.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.1 -1.0 . . . . 0.0 109.965 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.455 ' OG1' ' HB2' ' A' ' 54' ' ' ASP . 88.7 m -101.27 -34.44 9.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.081 -1.012 . . . . 0.0 111.349 -179.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.65 118.88 2.52 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.953 -1.092 . . . . 0.0 110.969 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.578 HG11 ' CE1' ' A' ' 28' ' ' TYR . 7.4 m -89.39 100.0 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.973 -1.08 . . . . 0.0 109.623 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.557 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 58.0 p -47.55 144.34 3.17 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.302 -0.874 . . . . 0.0 110.771 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.1 p -61.86 164.92 5.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.228 -0.92 . . . . 0.0 109.948 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.9 m -68.03 120.5 14.36 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.117 -0.99 . . . . 0.0 110.142 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.491 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 32.7 p-90 -146.52 -174.02 4.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 109.64 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.559 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 28.2 t-80 -162.78 171.51 16.64 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.861 -1.149 . . . . 0.0 111.117 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.559 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 22.0 m95 -78.74 93.76 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.472 -0.767 . . . . 0.0 110.151 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.469 ' O ' ' O ' ' B' ' 31' ' ' VAL . 4.0 t . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.266 0.555 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.55 HG23 ' N ' ' A' ' 49' ' ' VAL . 63.3 mt -141.89 149.65 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.37 -0.831 . . . . 0.0 110.153 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . 0.55 ' N ' HG23 ' A' ' 48' ' ' ILE . 40.4 t -120.2 121.32 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.275 -0.891 . . . . 0.0 110.814 -179.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.469 ' HB ' ' OG ' ' A' ' 32' ' ' SER . 33.2 m -93.73 148.95 21.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.329 -0.857 . . . . 0.0 109.131 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.482 HD23 ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -135.04 122.61 22.05 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.921 -1.112 . . . . 0.0 110.789 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 3' ' ' PRO . 26.1 m -98.12 144.26 27.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.547 -0.721 . . . . 0.0 109.416 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.501 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 55.2 m-85 -120.77 155.86 33.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.037 -1.039 . . . . 0.0 110.659 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . 0.455 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 2.9 t70 -78.16 -9.39 59.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 110.832 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 56' ' ' GLU . 3.0 m -163.3 127.67 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.053 -1.029 . . . . 0.0 110.341 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -45.28 -41.76 8.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.218 -0.926 . . . . 0.0 109.834 179.666 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . 0.463 ' HA ' ' CE3' ' A' ' 57' ' ' TRP . 6.1 t-105 -54.05 -51.03 65.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.367 -0.833 . . . . 0.0 110.077 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.43 ' HA ' ' NE2' ' A' ' 61' ' ' GLN . 4.3 tp60 -58.35 -37.78 75.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.266 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.4 ttp85 -59.14 -44.31 92.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.194 -0.941 . . . . 0.0 110.674 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -36.85 80.9 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.158 -0.964 . . . . 0.0 110.16 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.43 ' NE2' ' HA ' ' A' ' 58' ' ' GLN . 37.8 mt-30 -65.68 -41.19 92.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.161 -0.962 . . . . 0.0 110.388 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.465 ' CE1' HG22 ' A' ' 66' ' ' VAL . 23.5 t80 -55.96 -48.14 76.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.335 -0.853 . . . . 0.0 110.13 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.424 HD22 HG11 ' A' ' 74' ' ' VAL . 15.4 mt -59.09 -14.88 11.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.33 -0.857 . . . . 0.0 110.448 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.7 p -99.98 -21.46 15.64 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.7 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.422 ' OE1' HD21 ' A' ' 27' ' ' LEU . 31.6 mt-30 -94.13 -29.03 15.36 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.111 -0.993 . . . . 0.0 110.704 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.471 HG23 HG12 ' A' ' 68' ' ' ILE . 5.5 m -89.79 172.89 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.126 -0.984 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.67 91.73 3.69 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.887 . . . . 0.0 109.459 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.471 HG12 HG23 ' A' ' 66' ' ' VAL . 29.7 mm -88.64 107.48 17.31 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.266 -0.896 . . . . 0.0 110.452 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.474 ' HG2' ' CD1' ' A' ' 72' ' ' ILE . 43.9 Cg_endo -54.66 -169.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.002 1.528 . . . . 0.0 110.231 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.65 -6.77 24.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.265 -0.897 . . . . 0.0 110.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -84.71 -23.81 29.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.351 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.519 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.5 mt -94.2 135.42 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.439 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.1 m -95.14 119.84 34.33 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.158 -0.964 . . . . 0.0 110.328 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.424 HG11 HD22 ' A' ' 63' ' ' LEU . 88.0 t -102.15 97.72 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.86 . . . . 0.0 109.562 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 59.0 m -102.53 172.12 7.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.568 -1.333 . . . . 0.0 110.698 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.3 p -111.96 177.28 4.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.333 -0.855 . . . . 0.0 109.747 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.449 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -179.25 179.06 48.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.479 ' O ' ' O ' ' B' ' 78' ' ' PHE . 25.7 m-85 -147.75 136.87 22.23 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -1.1 . . . . 0.0 110.124 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.402 ' HE3' ' CD2' ' B' ' 6' ' ' HIS . 2.5 mtp -119.94 172.61 7.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.116 -0.99 . . . . 0.0 110.408 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.19 100.96 7.49 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.294 -0.879 . . . . 0.0 109.725 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.404 -179.472 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.472 ' HE2' ' HB3' ' B' ' 78' ' ' PHE . 3.2 mtp . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.175 0.512 . . . . 0.0 110.322 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.98 108.27 61.3 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.35 -0.844 . . . . 0.0 110.366 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.7 Cg_endo -67.87 143.26 60.26 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.917 1.483 . . . . 0.0 109.9 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.489 ' O ' HG11 ' B' ' 5' ' ' VAL . 2.8 pt -144.59 164.59 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.076 -1.015 . . . . 0.0 110.649 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.489 HG11 ' O ' ' B' ' 4' ' ' ILE . 16.8 m -144.4 147.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.524 -0.735 . . . . 0.0 109.504 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.402 ' CD2' ' HE3' ' A' ' 79' ' ' MET . 0.3 OUTLIER -105.84 128.2 53.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.995 -1.066 . . . . 0.0 110.53 -179.524 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.455 ' O ' ' CG2' ' B' ' 48' ' ' ILE . 0.2 OUTLIER -117.24 135.59 53.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.366 -0.834 . . . . 0.0 109.954 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 14.4 ttmt -139.78 164.35 30.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.211 -0.931 . . . . 0.0 110.11 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.403 ' H ' ' HG2' ' B' ' 8' ' ' LYS . . . 152.66 -175.7 31.14 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.79 136.39 56.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.322 -1.105 . . . . 0.0 110.127 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.15 -21.75 1.43 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.341 -0.849 . . . . 0.0 110.456 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -70.44 -58.99 3.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.203 -0.936 . . . . 0.0 110.024 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.416 ' O ' ' HG ' ' B' ' 17' ' ' LEU . 0.0 OUTLIER -58.1 -22.27 49.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.352 -0.843 . . . . 0.0 110.238 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 18.8 mt -66.75 -45.49 78.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.568 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.79 -31.13 69.4 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.153 -0.967 . . . . 0.0 110.325 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.488 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.1 t -70.28 -41.74 73.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.399 -0.813 . . . . 0.0 110.682 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' B' ' 13' ' ' THR . 83.2 mt -58.88 -52.69 64.65 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.018 -1.051 . . . . 0.0 110.333 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . 0.504 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 23.0 ttt-85 -48.68 -24.16 1.28 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.488 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 9.8 t80 -64.68 -40.62 95.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.025 -1.047 . . . . 0.0 110.316 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 69.9 mtm-85 -76.28 -14.82 60.1 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.226 -0.921 . . . . 0.0 110.038 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.504 ' HB2' ' O ' ' B' ' 18' ' ' ARG . 3.7 m-30 -66.57 -31.09 71.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.24 -0.913 . . . . 0.0 109.85 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -63.38 -33.89 76.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.373 -0.829 . . . . 0.0 110.169 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -74.85 -49.06 21.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.677 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.487 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 47.0 m-70 -94.9 28.79 2.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.378 -0.826 . . . . 0.0 109.748 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.598 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 21.2 p -57.07 -21.8 34.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.759 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 23.6 p -97.27 10.78 38.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 110.073 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' B' ' 24' ' ' HIS . 0.7 OUTLIER -92.16 -44.09 8.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.244 -0.91 . . . . 0.0 110.377 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.61 ' CE1' HG11 ' B' ' 31' ' ' VAL . 20.8 p90 -95.82 175.44 6.51 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.095 -1.003 . . . . 0.0 109.837 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.449 ' OG1' ' HB2' ' B' ' 54' ' ' ASP . 80.7 m -100.95 -33.69 10.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.108 -0.995 . . . . 0.0 111.429 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.75 118.82 2.48 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.049 -1.032 . . . . 0.0 110.972 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.61 HG11 ' CE1' ' B' ' 28' ' ' TYR . 8.1 m -89.43 99.84 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.649 179.074 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.491 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.2 p -47.24 143.18 3.43 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.317 -0.865 . . . . 0.0 110.776 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 14.1 p -61.62 164.48 5.94 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.907 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 65.8 m -68.04 121.02 15.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.114 -0.991 . . . . 0.0 110.345 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.557 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 31.2 p-90 -146.74 -173.43 4.21 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.341 -0.85 . . . . 0.0 109.539 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.549 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 28.9 t-80 -162.89 171.25 16.91 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.852 -1.155 . . . . 0.0 110.917 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.549 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 26.9 m95 -78.79 93.63 5.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.504 -0.748 . . . . 0.0 110.045 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.93 . . . . 0.0 110.438 179.955 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 121.35 0.595 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.546 HG23 ' N ' ' B' ' 49' ' ' VAL . 56.0 mt -141.87 150.29 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.171 -0.955 . . . . 0.0 110.098 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . 0.546 ' N ' HG23 ' B' ' 48' ' ' ILE . 41.3 t -121.11 121.17 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.233 -0.917 . . . . 0.0 110.731 -179.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.46 ' HB ' ' OG ' ' B' ' 32' ' ' SER . 40.7 m -93.89 148.85 21.75 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.292 -0.88 . . . . 0.0 109.17 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.497 HD23 ' CE2' ' B' ' 21' ' ' PHE . 0.4 OUTLIER -134.93 123.17 22.98 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.942 -1.099 . . . . 0.0 111.048 -179.417 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.479 ' HA ' ' O ' ' B' ' 3' ' ' PRO . 24.1 m -98.19 143.81 28.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.515 -0.741 . . . . 0.0 109.61 179.042 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.501 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -120.52 155.31 33.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.066 -1.021 . . . . 0.0 110.552 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.449 ' HB2' ' OG1' ' B' ' 29' ' ' THR . 3.0 t70 -77.69 -9.14 58.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.301 -0.874 . . . . 0.0 110.761 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.2 m -163.28 128.06 3.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.128 -0.983 . . . . 0.0 110.493 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -41.54 10.58 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.345 -0.847 . . . . 0.0 109.794 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . 0.456 ' HA ' ' CE3' ' B' ' 57' ' ' TRP . 6.0 t-105 -54.26 -51.22 65.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.318 -0.864 . . . . 0.0 110.027 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.44 ' CA ' ' OE1' ' B' ' 58' ' ' GLN . 4.1 tp60 -58.21 -37.25 74.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.16 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 40.0 ttp85 -59.32 -44.84 92.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.091 -1.006 . . . . 0.0 110.609 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -36.87 80.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.157 -0.964 . . . . 0.0 110.286 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.411 ' NE2' ' HA ' ' B' ' 58' ' ' GLN . 38.4 mt-30 -65.74 -41.08 92.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.292 -0.88 . . . . 0.0 110.29 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.49 ' CE1' HG22 ' B' ' 66' ' ' VAL . 21.5 t80 -56.11 -48.28 76.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 0.0 110.223 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 15.0 mt -59.04 -14.2 8.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.357 -0.839 . . . . 0.0 110.277 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 17.8 p -100.54 -21.91 15.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.249 -0.907 . . . . 0.0 110.842 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . 0.423 ' OE1' HD21 ' B' ' 27' ' ' LEU . 30.3 mt-30 -94.09 -28.67 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.026 -1.046 . . . . 0.0 110.596 -178.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.49 HG22 ' CE1' ' B' ' 62' ' ' PHE . 5.5 m -89.57 173.13 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.033 -1.042 . . . . 0.0 110.028 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.14 92.63 3.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.219 -0.926 . . . . 0.0 109.28 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.458 HG12 HG23 ' B' ' 66' ' ' VAL . 30.2 mm -88.99 107.23 16.39 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.366 -0.834 . . . . 0.0 110.438 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.464 ' HG2' ' CD1' ' B' ' 72' ' ' ILE . 44.8 Cg_endo -54.18 -168.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 124.034 1.544 . . . . 0.0 110.145 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.17 -6.52 24.17 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.138 -0.976 . . . . 0.0 110.411 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 47.8 p -84.84 -23.54 29.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.268 -0.895 . . . . 0.0 110.382 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.507 ' HA ' ' O ' ' B' ' 8' ' ' LYS . 3.5 mt -94.15 135.23 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.258 -0.901 . . . . 0.0 110.416 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 39.7 m -95.22 119.87 34.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.174 -0.954 . . . . 0.0 110.217 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 88.6 t -101.81 97.69 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.171 -0.956 . . . . 0.0 109.42 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 58.2 m -102.47 172.2 7.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.476 -1.39 . . . . 0.0 110.628 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 72.8 p -112.53 176.34 5.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.401 -0.812 . . . . 0.0 109.823 179.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . 0.434 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -178.45 179.44 48.64 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.479 ' O ' ' O ' ' A' ' 78' ' ' PHE . 26.7 m-85 -147.57 137.35 22.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -1.149 . . . . 0.0 110.194 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.568 ' HE3' ' CD2' ' A' ' 6' ' ' HIS . 2.6 mtp -120.11 172.64 7.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.129 -0.982 . . . . 0.0 110.338 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.78 100.97 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.305 -0.872 . . . . 0.0 109.73 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.191 -179.542 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' MET . . . . . 0.416 ' SD ' ' CE2' ' A' ' 78' ' ' PHE . 69.1 mtp . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.188 0.518 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.5 p -143.97 144.99 28.54 Favored Pre-proline 0 N--CA 1.491 1.577 0 O-C-N 121.253 -0.905 . . . . 0.0 110.272 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.487 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 51.7 Cg_endo -94.16 155.93 2.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.047 1.551 . . . . 0.0 110.062 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . 0.446 HD11 ' HG3' ' A' ' 79' ' ' MET . 11.4 pt -144.32 166.55 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.136 -0.977 . . . . 0.0 110.563 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.509 HG11 ' CG2' ' A' ' 74' ' ' VAL . 24.4 t -145.72 124.14 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.378 -0.827 . . . . 0.0 110.017 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.499 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.2 OUTLIER -105.69 110.57 22.92 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 110.274 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.517 ' O ' ' CG2' ' A' ' 48' ' ' ILE . 1.7 tp -112.97 150.59 31.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.201 -0.937 . . . . 0.0 110.258 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.476 ' N ' ' HG ' ' A' ' 7' ' ' LEU . 8.5 ttpp -142.33 170.43 15.72 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.51 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.432 ' O ' HD11 ' A' ' 14' ' ' LEU . . . 151.24 -179.87 27.54 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -65.04 137.12 57.5 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.276 -1.132 . . . . 0.0 110.217 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.32 -31.44 14.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.31 -0.869 . . . . 0.0 110.629 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -71.14 -55.1 8.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.224 -0.922 . . . . 0.0 110.765 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.1 m -57.85 -20.46 36.56 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.189 -0.945 . . . . 0.0 110.398 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . 0.432 HD11 ' O ' ' A' ' 9' ' ' GLY . 20.9 mt -90.34 -25.05 20.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.309 -0.87 . . . . 0.0 110.083 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.4 mmtp -58.88 -42.62 89.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.345 -0.847 . . . . 0.0 110.294 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.433 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 19.0 t -69.8 -34.5 73.8 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.425 -0.797 . . . . 0.0 110.435 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 19' ' ' TYR . 5.3 mp -58.85 -53.59 56.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.35 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -44.87 -22.97 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.8 -179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.433 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 85.7 t80 -64.57 -42.91 95.33 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.101 -0.999 . . . . 0.0 109.877 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -62.6 -27.44 69.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.864 . . . . 0.0 109.969 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.526 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.6 -16.86 64.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.375 -0.828 . . . . 0.0 110.264 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -63.44 -56.11 18.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 109.804 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.448 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.27 -24.76 57.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.399 -0.813 . . . . 0.0 109.834 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.478 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 19.5 m170 -94.97 33.21 1.53 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.397 -0.815 . . . . 0.0 110.015 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.463 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 23.0 p -57.28 -23.79 50.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.349 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.7 t -97.28 13.52 29.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.194 -0.941 . . . . 0.0 110.687 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.478 ' HB2' ' O ' ' A' ' 24' ' ' HIS . 3.3 mp -92.31 -26.54 18.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -0.983 . . . . 0.0 110.32 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.463 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 34.8 p90 -118.39 167.89 11.14 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -0.988 . . . . 0.0 110.034 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.494 ' N ' ' O ' ' A' ' 52' ' ' THR . 3.6 m -100.01 -34.24 10.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.127 -0.983 . . . . 0.0 110.457 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.62 117.06 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.926 . . . . 0.0 110.636 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.8 p -90.21 129.74 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.113 -0.992 . . . . 0.0 109.919 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.491 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 2.0 t -87.4 148.1 25.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.235 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 p -61.18 167.31 3.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.21 -0.931 . . . . 0.0 110.45 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.02 121.07 15.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.281 -0.887 . . . . 0.0 110.538 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.457 ' O ' ' N ' ' A' ' 48' ' ' ILE . 36.8 p-90 -146.93 175.47 10.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.247 -0.908 . . . . 0.0 109.847 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.493 ' HB3' ' HA ' ' A' ' 47' ' ' ALA . 15.2 p-80 -162.57 173.39 14.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.07 -1.019 . . . . 0.0 110.702 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.4 ' CZ2' ' HH2' ' A' ' 35' ' ' TRP . 92.2 m95 -79.66 125.35 29.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.531 -0.73 . . . . 0.0 110.106 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.5 t . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.076 -1.015 . . . . 0.0 110.269 179.913 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.373 0.606 . . . . 0.0 110.679 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.517 ' CG2' ' O ' ' A' ' 7' ' ' LEU . 46.3 mt -141.98 131.42 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.187 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.3 t -118.34 125.89 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.243 -0.911 . . . . 0.0 110.189 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 88.0 m -93.82 157.43 16.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.221 -0.924 . . . . 0.0 110.094 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.6 mt -134.84 128.21 32.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.179 -0.951 . . . . 0.0 110.07 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.494 ' O ' ' N ' ' A' ' 29' ' ' THR . 28.4 p -97.12 131.6 43.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.503 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 48.6 m-85 -112.52 150.21 31.6 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.185 -0.947 . . . . 0.0 110.218 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -74.96 -7.65 54.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.221 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.8 p -170.74 157.94 5.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.27 -0.894 . . . . 0.0 110.197 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.54 -37.64 88.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.325 -0.859 . . . . 0.0 110.354 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -54.03 -53.59 50.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.155 -0.965 . . . . 0.0 110.324 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -58.22 -35.46 71.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.299 -0.875 . . . . 0.0 110.44 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . 0.481 ' NH2' ' CG2' ' A' ' 76' ' ' THR . 22.4 ttt180 -58.91 -42.55 89.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.047 -1.033 . . . . 0.0 109.963 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -34.8 76.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -65.62 -45.5 82.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.185 -0.947 . . . . 0.0 110.466 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.576 ' CE1' HG23 ' A' ' 66' ' ' VAL . 3.0 t80 -55.96 -49.47 73.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.279 -0.888 . . . . 0.0 110.826 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . 0.402 ' O ' HG22 ' A' ' 66' ' ' VAL . 97.6 mt -59.28 -46.06 89.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.266 -0.896 . . . . 0.0 110.765 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.1 -20.59 66.54 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.129 -0.982 . . . . 0.0 110.417 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -95.81 -17.39 21.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.91 . . . . 0.0 110.42 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.576 HG23 ' CE1' ' A' ' 62' ' ' PHE . 10.9 m -108.66 113.44 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -0.939 . . . . 0.0 110.409 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 115.62 9.9 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 110.064 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 4.2 tp -88.31 142.62 31.67 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.194 -0.941 . . . . 0.0 110.207 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.451 ' CG ' HD12 ' A' ' 72' ' ' ILE . 47.8 Cg_endo -94.72 162.4 1.81 Allowed 'Trans proline' 0 C--N 1.305 -1.762 0 O-C-N 124.034 1.544 . . . . 0.0 110.464 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -65.35 -16.76 63.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.227 -0.921 . . . . 0.0 110.347 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.3 m -84.68 -31.42 24.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 110.576 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.451 HD12 ' CG ' ' A' ' 69' ' ' PRO . 75.6 mt -93.51 148.94 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.096 -1.003 . . . . 0.0 110.641 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.512 HG22 ' N ' ' A' ' 74' ' ' VAL . 87.7 m -145.52 154.15 41.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.399 -0.813 . . . . 0.0 109.994 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.512 ' N ' HG22 ' A' ' 73' ' ' THR . 6.0 p -147.12 162.81 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.108 -0.995 . . . . 0.0 110.647 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.25 -179.63 5.98 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.439 -0.788 . . . . 0.0 109.997 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.481 ' CG2' ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -108.08 167.72 9.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.159 -0.963 . . . . 0.0 110.354 -179.813 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . 0.454 ' HA3' ' HE3' ' B' ' 79' ' ' MET . . . -169.79 177.71 43.1 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . 0.416 ' CE2' ' SD ' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.81 135.86 21.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.37 -1.077 . . . . 0.0 110.114 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.446 ' HG3' HD11 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -117.87 153.86 32.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.253 -0.904 . . . . 0.0 110.269 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.8 p -125.35 100.73 6.64 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.285 -0.884 . . . . 0.0 110.176 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.4 tt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.19 -179.966 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 1' ' ' MET . . . . . 0.443 ' O ' HG23 ' B' ' 2' ' ' THR . 71.3 mtp . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.164 0.507 . . . . 0.0 110.081 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 2' ' ' THR . . . . . 0.443 HG23 ' O ' ' B' ' 1' ' ' MET . 29.2 p -145.34 143.39 20.09 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.17 -0.956 . . . . 0.0 110.343 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.488 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.8 Cg_endo -92.49 155.9 3.0 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.068 1.562 . . . . 0.0 110.214 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . 0.407 HD11 ' HG3' ' B' ' 79' ' ' MET . 11.2 pt -144.23 166.36 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 110.501 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.509 ' CG1' HG21 ' B' ' 74' ' ' VAL . 24.5 t -145.77 124.07 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.264 -0.898 . . . . 0.0 110.03 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.502 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.2 OUTLIER -105.59 111.11 23.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 110.343 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.515 ' O ' ' CG2' ' B' ' 48' ' ' ILE . 1.8 tp -113.32 150.13 32.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 110.138 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.455 ' N ' ' HG ' ' B' ' 7' ' ' LEU . 8.5 ttpp -142.04 169.98 16.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.278 -0.889 . . . . 0.0 110.312 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.414 ' HA3' HG12 ' B' ' 72' ' ' ILE . . . 151.96 -179.98 28.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -65.07 137.85 57.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.204 -1.174 . . . . 0.0 110.199 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.43 -31.9 16.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.262 -0.899 . . . . 0.0 110.573 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -70.92 -55.16 9.01 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.273 -0.892 . . . . 0.0 110.846 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.3 m -57.5 -20.96 34.7 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.179 -0.951 . . . . 0.0 110.391 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . 0.413 HD11 ' O ' ' B' ' 9' ' ' GLY . 19.3 mt -90.15 -24.8 20.96 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp -58.91 -42.68 90.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.338 -0.851 . . . . 0.0 110.251 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.445 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.8 t -69.6 -34.98 74.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.417 -0.802 . . . . 0.0 110.36 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' B' ' 19' ' ' TYR . 5.5 mp -58.69 -53.64 56.13 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.343 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.2 ttp85 -44.59 -23.44 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.217 -0.927 . . . . 0.0 110.728 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.445 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 85.8 t80 -64.51 -43.43 94.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.022 -1.049 . . . . 0.0 109.852 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 7.8 mtp85 -61.97 -27.51 68.9 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.391 -0.818 . . . . 0.0 109.987 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.56 -16.99 64.57 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.283 -0.886 . . . . 0.0 110.268 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -63.47 -56.07 19.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.0 109.806 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . 0.44 ' HD3' ' N ' ' B' ' 23' ' ' LYS . 0.0 OUTLIER -75.07 -24.91 58.27 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 109.875 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.48 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 18.7 m170 -94.93 32.89 1.57 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.413 -0.805 . . . . 0.0 110.106 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.491 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 24.8 p -57.19 -23.6 48.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 0.0 110.395 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.7 t -97.26 13.42 29.53 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 110.674 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' B' ' 24' ' ' HIS . 3.2 mp -92.35 -26.39 18.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.491 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 33.9 p90 -118.36 167.97 11.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.11 -0.994 . . . . 0.0 109.979 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.489 ' N ' ' O ' ' B' ' 52' ' ' THR . 3.7 m -100.29 -34.23 10.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.203 -0.936 . . . . 0.0 110.492 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.52 116.37 2.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.21 -0.931 . . . . 0.0 110.624 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.424 HG23 HD21 ' B' ' 51' ' ' LEU . 14.5 p -90.02 129.89 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 110.005 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.446 ' OG ' ' CE3' ' A' ' 35' ' ' TRP . 2.1 t -87.54 148.41 24.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.41 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.5 p -61.07 166.99 3.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.413 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.99 120.77 14.79 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.287 -0.883 . . . . 0.0 110.423 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.491 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 37.2 p-90 -146.58 175.26 10.72 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.224 -0.922 . . . . 0.0 109.932 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.486 ' HB3' ' HA ' ' B' ' 47' ' ' ALA . 16.7 p-80 -162.5 172.97 14.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.092 -1.005 . . . . 0.0 110.724 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.412 ' CZ2' ' HH2' ' B' ' 35' ' ' TRP . 92.7 m95 -79.45 124.57 28.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.502 -0.749 . . . . 0.0 110.078 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 7.0 t . . . . . 0 N--CA 1.492 1.653 0 O-C-N 121.256 -0.902 . . . . 0.0 110.318 179.97 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.486 ' HA ' ' HB3' ' B' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 121.243 0.544 . . . . 0.0 110.657 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.515 ' CG2' ' O ' ' B' ' 7' ' ' LEU . 46.7 mt -142.06 130.31 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.376 -0.828 . . . . 0.0 110.101 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 4.2 t -117.34 125.96 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.884 . . . . 0.0 110.177 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 88.0 m -93.79 157.5 16.11 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . 0.424 HD21 HG23 ' B' ' 31' ' ' VAL . 9.4 mt -135.09 128.36 32.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 110.286 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.489 ' O ' ' N ' ' B' ' 29' ' ' THR . 30.7 p -97.22 132.2 43.21 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.279 -0.888 . . . . 0.0 110.276 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.498 ' N ' ' CD1' ' B' ' 53' ' ' TYR . 49.0 m-85 -113.01 150.36 32.04 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.288 -0.882 . . . . 0.0 110.021 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -75.13 -7.22 53.17 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.895 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 24.9 p -170.72 157.72 5.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.317 -0.864 . . . . 0.0 110.283 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.46 -38.21 90.24 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.265 -0.897 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 8.5 t-105 -53.83 -53.72 48.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.363 -0.836 . . . . 0.0 110.447 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -57.74 -35.43 70.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.473 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . 0.468 ' NH2' ' CG2' ' B' ' 76' ' ' THR . 23.3 ttt180 -58.94 -42.81 90.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.075 -1.016 . . . . 0.0 110.123 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.41 -34.48 75.45 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.322 -0.861 . . . . 0.0 110.333 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -65.77 -45.26 83.16 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.248 -0.908 . . . . 0.0 110.393 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.567 ' CE1' HG23 ' B' ' 66' ' ' VAL . 3.2 t80 -56.1 -49.66 73.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.281 -0.887 . . . . 0.0 110.763 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . 0.403 ' O ' HG22 ' B' ' 66' ' ' VAL . 97.5 mt -59.22 -46.15 89.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.192 -0.942 . . . . 0.0 110.746 -179.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.18 -20.7 66.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.204 -0.935 . . . . 0.0 110.436 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -95.7 -17.95 20.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.275 -0.89 . . . . 0.0 110.392 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.567 HG23 ' CE1' ' B' ' 62' ' ' PHE . 12.4 m -107.87 114.22 45.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.244 -0.91 . . . . 0.0 110.328 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.41 115.94 11.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.045 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 4.1 tp -88.07 143.65 33.33 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.198 -0.939 . . . . 0.0 110.264 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.441 ' CG ' HD12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -95.71 161.83 1.45 Allowed 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.059 1.557 . . . . 0.0 110.344 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -65.23 -16.3 63.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.302 -0.874 . . . . 0.0 110.251 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 40.7 m -84.88 -31.35 23.77 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.256 -0.903 . . . . 0.0 110.463 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.441 HD12 ' CG ' ' B' ' 69' ' ' PRO . 70.4 mt -93.65 148.83 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.157 -0.964 . . . . 0.0 110.599 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' THR . . . . . 0.515 HG22 ' N ' ' B' ' 74' ' ' VAL . 90.9 m -145.5 154.14 41.89 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.354 -0.842 . . . . 0.0 110.028 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.515 ' N ' HG22 ' B' ' 73' ' ' THR . 6.1 p -147.22 162.81 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.112 -0.992 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.16 -179.86 6.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.375 -0.828 . . . . 0.0 109.955 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' THR . . . . . 0.468 ' CG2' ' NH2' ' B' ' 59' ' ' ARG . 0.2 OUTLIER -107.72 167.47 9.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 0.0 110.435 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.24 177.5 42.88 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . 0.425 ' CE2' ' SD ' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.73 135.95 21.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.26 -1.141 . . . . 0.0 110.111 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.454 ' HE3' ' HA3' ' A' ' 77' ' ' GLY . 0.2 OUTLIER -117.94 154.24 32.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 110.281 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.5 p -125.5 100.69 6.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 110.132 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.25 -179.918 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtp . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.279 0.562 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.37 160.46 25.96 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.863 . . . . 0.0 109.989 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' PRO . . . . . 0.501 ' CG ' ' O ' ' A' ' 53' ' ' TYR . 51.8 Cg_endo -114.82 159.16 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 123.885 1.466 . . . . 0.0 110.09 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 pt -144.49 164.37 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 110.221 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.402 ' CG1' ' CG2' ' A' ' 74' ' ' VAL . 97.8 t -145.94 127.64 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' HIS . . . . . 0.481 ' HB2' ' CE ' ' B' ' 79' ' ' MET . 0.1 OUTLIER -105.63 115.81 30.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.0 110.473 -179.673 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . 0.538 ' O ' ' CG2' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -118.53 149.76 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.382 -0.824 . . . . 0.0 109.909 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.46 ' N ' ' HG ' ' A' ' 7' ' ' LEU . 7.4 ttpt -142.72 171.89 13.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.043 -1.036 . . . . 0.0 110.637 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLY . . . . . 0.439 ' HA3' HG12 ' A' ' 72' ' ' ILE . . . 151.51 173.86 21.75 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -64.99 138.23 58.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.16 -1.2 . . . . 0.0 110.056 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.29 -25.56 3.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.25 -0.906 . . . . 0.0 110.691 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 15' ' ' LYS . 25.9 t30 -65.55 -61.36 2.14 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.961 . . . . 0.0 110.598 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' THR . . . . . 0.458 ' HB ' HD13 ' A' ' 72' ' ' ILE . 0.2 OUTLIER -57.87 -32.47 67.71 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.101 -0.999 . . . . 0.0 110.338 -179.769 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -67.75 -30.29 69.72 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 0.0 110.01 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 10.0 mmtp -59.99 -45.61 92.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.216 -0.928 . . . . 0.0 110.149 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.508 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 5.7 t -70.08 -36.56 75.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.472 -0.767 . . . . 0.0 110.739 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.9 -56.69 19.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.899 -1.125 . . . . 0.0 110.668 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -47.08 -21.33 0.22 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.676 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.508 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 91.0 t80 -64.27 -27.25 68.91 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.006 -1.059 . . . . 0.0 109.818 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 -79.6 -31.9 41.8 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.264 -0.898 . . . . 0.0 109.882 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . 0.557 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 8.8 m-30 -66.33 -14.93 62.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -0.863 . . . . 0.0 110.101 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -63.43 -55.67 22.38 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 1.8 mptt -75.18 -22.7 57.84 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' HIS . . . . . 0.57 ' N ' ' CD2' ' A' ' 24' ' ' HIS . 11.3 m170 -95.04 38.93 1.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.264 -0.897 . . . . 0.0 110.172 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' CYS . . . . . 0.482 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 25.1 p -57.0 -25.43 58.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.358 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.8 t -97.49 11.34 37.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.268 -0.895 . . . . 0.0 110.76 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.524 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 3.0 mp -92.33 -32.41 15.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.083 -1.011 . . . . 0.0 110.355 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' TYR . . . . . 0.482 ' CE1' ' HA ' ' A' ' 25' ' ' CYS . 50.6 p90 -113.38 171.74 7.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.189 -0.945 . . . . 0.0 109.615 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.471 ' HB ' ' O ' ' A' ' 52' ' ' THR . 61.7 m -101.16 -36.22 9.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.056 -1.028 . . . . 0.0 111.064 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.4 122.54 3.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.023 -1.048 . . . . 0.0 110.798 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.448 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 11.0 p -88.16 108.16 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.162 -0.961 . . . . 0.0 109.891 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . 0.556 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -63.46 146.55 53.4 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.423 -0.798 . . . . 0.0 110.99 -179.403 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . 0.462 ' HB3' HG23 ' B' ' 38' ' ' THR . 36.3 p -61.58 163.41 7.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.403 -0.811 . . . . 0.0 110.258 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 115.62 7.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.321 -0.862 . . . . 0.0 110.647 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TRP . . . . . 0.558 ' CB ' ' HB3' ' B' ' 35' ' ' TRP . 16.5 p-90 -146.92 168.66 20.92 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.267 -0.896 . . . . 0.0 110.091 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.546 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 14.2 p-80 -162.47 178.48 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . 0.571 ' CH2' HG23 ' B' ' 52' ' ' THR . 80.4 m95 -79.73 125.18 29.33 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.551 -0.718 . . . . 0.0 110.467 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' THR . . . . . 0.482 HG23 ' HB3' ' B' ' 33' ' ' SER . 7.1 t . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.918 . . . . 0.0 110.271 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ALA . . . . . 0.469 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.228 0.537 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ILE . . . . . 0.538 ' CG2' ' O ' ' A' ' 7' ' ' LEU . 45.7 mt -140.83 131.34 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.271 -0.893 . . . . 0.0 110.262 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 52.9 t -110.48 117.18 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.308 -0.87 . . . . 0.0 110.691 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 96.2 m -94.14 153.81 17.91 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.21 -0.931 . . . . 0.0 109.626 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.8 mp -136.31 131.2 34.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.931 -1.106 . . . . 0.0 110.497 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.634 ' CG2' ' CH2' ' B' ' 37' ' ' TRP . 7.6 p -97.34 135.07 39.77 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.394 -0.816 . . . . 0.0 110.042 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' TYR . . . . . 0.501 ' O ' ' CG ' ' A' ' 3' ' ' PRO . 88.8 m-85 -111.23 148.75 32.16 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.136 -0.978 . . . . 0.0 110.396 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -81.97 -8.79 59.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.213 -0.93 . . . . 0.0 110.151 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.94 138.45 6.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.334 -0.854 . . . . 0.0 110.196 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -54.79 -39.2 68.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.252 -0.905 . . . . 0.0 110.266 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.77 -51.74 62.45 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 51.3 tt0 -57.12 -40.79 77.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.359 -0.838 . . . . 0.0 110.743 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -59.18 -36.87 76.1 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.036 -1.04 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.08 -44.5 97.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.947 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 47.8 mt-30 -65.61 -39.0 91.06 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.124 -0.985 . . . . 0.0 110.619 -179.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' PHE . . . . . 0.45 ' CD1' ' C ' ' A' ' 62' ' ' PHE . 3.0 t80 -54.85 -48.21 73.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.163 -0.961 . . . . 0.0 110.221 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -59.8 -25.95 65.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.191 -0.943 . . . . 0.0 110.163 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.78 -20.41 42.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.299 -0.875 . . . . 0.0 110.628 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 9.1 mm-40 -96.18 -20.58 18.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.159 -0.963 . . . . 0.0 110.418 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' VAL . . . . . 0.474 ' O ' HG22 ' A' ' 66' ' ' VAL . 32.2 m -103.24 118.96 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.247 -0.908 . . . . 0.0 110.413 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -78.31 114.09 16.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ILE . . . . . 0.433 HD12 HG22 ' A' ' 72' ' ' ILE . 3.5 tp -88.52 137.42 30.52 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.296 -0.878 . . . . 0.0 110.053 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.447 ' HD2' ' HB ' ' A' ' 72' ' ' ILE . 46.7 Cg_endo -98.82 159.95 0.68 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.894 1.47 . . . . 0.0 110.329 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.82 -13.04 8.8 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.238 -0.914 . . . . 0.0 110.157 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 94.5 m -84.28 -38.01 20.99 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.265 -0.897 . . . . 0.0 110.028 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' ILE . . . . . 0.494 HG21 ' N ' ' A' ' 73' ' ' THR . 72.4 mt -93.97 149.48 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.314 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' THR . . . . . 0.494 ' N ' HG21 ' A' ' 72' ' ' ILE . 23.4 m -144.9 153.82 41.97 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.235 -0.915 . . . . 0.0 110.029 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.458 ' HA ' ' O ' ' A' ' 6' ' ' HIS . 3.3 p -146.54 159.47 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.664 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.54 -179.36 5.86 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.386 -0.821 . . . . 0.0 110.164 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 m -107.93 170.88 7.72 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.177 -0.952 . . . . 0.0 110.719 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.37 -178.57 40.72 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.1 138.0 22.53 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.237 -1.155 . . . . 0.0 110.246 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' MET . . . . . 0.531 ' CE ' ' HB2' ' B' ' 6' ' ' HIS . 0.9 OUTLIER -121.06 170.71 9.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.243 -0.911 . . . . 0.0 110.092 179.847 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' SER . . . . . 0.497 ' OG ' ' O ' ' A' ' 80' ' ' SER . 1.3 p -137.73 103.92 5.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 110.408 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . 0.541 ' O ' ' CG1' ' A' ' 81' ' ' ILE . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.114 -0.946 . . . . 0.0 109.976 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 64.8 mtp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.27 0.557 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.67 160.96 24.27 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 110.063 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . 0.502 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 49.9 Cg_endo -115.53 158.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 123.894 1.471 . . . . 0.0 110.04 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.0 pt -144.49 164.01 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 110.367 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' VAL . . . . . 0.404 ' CG1' ' CG2' ' B' ' 74' ' ' VAL . 98.0 t -145.84 127.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 109.955 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' HIS . . . . . 0.531 ' HB2' ' CE ' ' A' ' 79' ' ' MET . 0.1 OUTLIER -105.47 116.1 31.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.232 -0.917 . . . . 0.0 110.537 -179.642 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' LEU . . . . . 0.536 ' O ' ' CG2' ' B' ' 48' ' ' ILE . 0.6 OUTLIER -118.56 149.69 40.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.779 179.652 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' LYS . . . . . 0.449 ' N ' ' HG ' ' B' ' 7' ' ' LEU . 7.3 ttpt -142.43 172.31 12.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.076 -1.015 . . . . 0.0 110.461 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' GLY . . . . . 0.447 ' HA3' HG12 ' B' ' 72' ' ' ILE . . . 150.82 174.1 21.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 36.5 m-20 -65.08 138.55 58.39 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.152 -1.205 . . . . 0.0 110.252 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.47 -25.16 3.68 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' B' ' 15' ' ' LYS . 26.4 t30 -66.54 -61.49 1.96 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 0.0 110.692 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' THR . . . . . 0.461 ' HB ' HD13 ' B' ' 72' ' ' ILE . 0.2 OUTLIER -57.77 -31.72 66.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.053 -1.029 . . . . 0.0 110.388 -179.841 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.24 -30.55 69.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.184 -0.947 . . . . 0.0 110.008 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' B' ' 12' ' ' ASN . 10.2 mmtp -59.65 -45.45 91.97 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.19 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' CYS . . . . . 0.513 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 5.8 t -70.09 -36.25 74.77 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.881 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 mp -58.94 -56.91 16.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.978 -1.076 . . . . 0.0 110.648 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 12.9 ttp85 -47.1 -21.43 0.24 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.263 -0.898 . . . . 0.0 110.655 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 91.5 t80 -64.19 -27.23 68.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.072 -1.017 . . . . 0.0 109.759 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -79.77 -31.66 40.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.354 -0.841 . . . . 0.0 109.836 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . 0.554 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.4 m-30 -66.44 -15.01 63.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.289 -0.882 . . . . 0.0 110.068 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -63.36 -55.94 20.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . 0.481 ' HD3' ' N ' ' B' ' 23' ' ' LYS . 1.7 mptt -75.05 -22.59 58.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.216 -0.928 . . . . 0.0 110.252 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' HIS . . . . . 0.566 ' CD2' ' N ' ' B' ' 24' ' ' HIS . 12.8 m170 -95.01 38.63 1.12 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' CYS . . . . . 0.518 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 25.1 p -57.13 -25.45 58.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.183 -0.948 . . . . 0.0 110.521 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 14.9 t -97.57 11.37 37.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.191 -0.943 . . . . 0.0 110.615 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' LEU . . . . . 0.512 ' O ' ' NE2' ' B' ' 58' ' ' GLN . 3.3 mp -92.3 -32.23 15.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.136 -0.978 . . . . 0.0 110.32 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' TYR . . . . . 0.518 ' CE1' ' HA ' ' B' ' 25' ' ' CYS . 50.2 p90 -113.49 172.06 7.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.236 -0.915 . . . . 0.0 109.665 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' THR . . . . . 0.469 ' HB ' ' O ' ' B' ' 52' ' ' THR . 57.3 m -101.49 -36.37 8.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.035 -1.04 . . . . 0.0 111.065 -179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.39 122.46 3.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.043 -1.035 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' VAL . . . . . 0.446 ' CG1' ' O ' ' B' ' 31' ' ' VAL . 11.1 p -88.15 109.57 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.276 -0.89 . . . . 0.0 109.816 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' SER . . . . . 0.543 ' HB2' ' CZ3' ' A' ' 37' ' ' TRP . 0.3 OUTLIER -64.88 146.87 54.32 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.427 -0.796 . . . . 0.0 111.173 -179.254 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' SER . . . . . 0.482 ' HB3' HG23 ' A' ' 38' ' ' THR . 78.4 p -61.41 163.06 7.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.373 -0.83 . . . . 0.0 110.081 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.25 115.77 8.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.338 -0.851 . . . . 0.0 110.512 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' TRP . . . . . 0.558 ' HB3' ' CB ' ' A' ' 35' ' ' TRP . 17.7 p-90 -146.99 168.97 20.2 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.126 -0.984 . . . . 0.0 110.13 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' HIS . . . . . 0.518 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 12.7 p-80 -162.6 178.54 8.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 110.734 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' TRP . . . . . 0.634 ' CH2' ' CG2' ' A' ' 52' ' ' THR . 79.5 m95 -79.72 125.05 29.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.487 -0.758 . . . . 0.0 110.218 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' THR . . . . . 0.462 HG23 ' HB3' ' A' ' 33' ' ' SER . 6.8 t . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.313 -0.867 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' ALA . . . . . 0.475 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.309 0.576 . . . . 0.0 110.091 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' ILE . . . . . 0.536 ' CG2' ' O ' ' B' ' 7' ' ' LEU . 44.2 mt -140.74 131.89 29.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.208 -0.932 . . . . 0.0 110.2 -179.134 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 53.7 t -111.11 116.64 53.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.21 -0.931 . . . . 0.0 110.53 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' THR . . . . . 0.404 ' O ' ' HB3' ' B' ' 32' ' ' SER . 98.2 m -93.72 154.03 18.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -0.894 . . . . 0.0 109.535 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 mp -136.17 131.44 34.65 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 110.54 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' THR . . . . . 0.571 HG23 ' CH2' ' A' ' 37' ' ' TRP . 9.1 p -97.62 135.3 39.64 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.273 -0.892 . . . . 0.0 110.028 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' TYR . . . . . 0.502 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 91.1 m-85 -111.46 148.7 32.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.085 -1.009 . . . . 0.0 110.354 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' ASP . . . . . 0.419 ' OD2' ' OG1' ' B' ' 29' ' ' THR . 37.9 m-20 -82.46 -8.65 59.61 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.14 -0.975 . . . . 0.0 110.045 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.16 138.34 7.73 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 110.147 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -55.25 -39.25 69.55 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.339 -0.851 . . . . 0.0 110.169 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.71 -52.06 61.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 110.14 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 52.1 tt0 -57.07 -41.04 78.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.411 -0.805 . . . . 0.0 110.751 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -59.02 -36.2 74.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.977 -1.077 . . . . 0.0 110.267 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.272 -0.893 . . . . 0.0 110.984 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 47.5 mt-30 -65.42 -38.55 90.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.599 -179.334 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' B' ' 62' ' ' PHE . 4.0 t80 -54.85 -48.18 73.23 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.64 -25.79 64.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.215 -0.928 . . . . 0.0 110.388 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.22 -20.42 41.11 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.325 -0.859 . . . . 0.0 110.505 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' B' ' 61' ' ' GLN . 8.9 mm-40 -96.4 -19.31 19.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.286 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' VAL . . . . . 0.458 HG22 ' O ' ' B' ' 66' ' ' VAL . 30.1 m -104.9 118.38 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.2 -0.937 . . . . 0.0 110.232 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -77.94 114.51 16.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.268 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' ILE . . . . . 0.417 HD12 HG22 ' B' ' 72' ' ' ILE . 3.3 tp -88.74 137.26 30.19 Favored Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.228 -0.92 . . . . 0.0 110.151 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' PRO . . . . . 0.465 ' HD2' ' HB ' ' B' ' 72' ' ' ILE . 47.8 Cg_endo -98.43 160.25 0.76 Allowed 'Trans proline' 0 C--N 1.303 -1.832 0 O-C-N 123.911 1.48 . . . . 0.0 110.212 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.03 -12.95 9.31 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.16 -0.962 . . . . 0.0 110.12 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 87.1 m -84.49 -38.24 20.34 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 110.118 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' ILE . . . . . 0.506 HG21 ' N ' ' B' ' 73' ' ' THR . 78.9 mt -93.81 149.76 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.219 -0.925 . . . . 0.0 110.229 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' THR . . . . . 0.506 ' N ' HG21 ' B' ' 72' ' ' ILE . 23.4 m -144.87 153.87 42.04 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.33 -0.857 . . . . 0.0 110.147 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' VAL . . . . . 0.466 ' HA ' ' O ' ' B' ' 6' ' ' HIS . 3.3 p -146.4 159.66 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.179 -0.95 . . . . 0.0 110.642 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 -179.55 6.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.418 -0.801 . . . . 0.0 110.04 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.5 m -107.8 170.93 7.69 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.081 -1.012 . . . . 0.0 110.715 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.5 -178.91 41.02 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -147.79 138.18 23.02 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -1.137 . . . . 0.0 110.34 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' MET . . . . . 0.481 ' CE ' ' HB2' ' A' ' 6' ' ' HIS . 0.5 OUTLIER -121.4 170.46 9.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.379 -0.825 . . . . 0.0 110.053 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' B' ' 80' ' ' SER . 1.3 p -137.64 104.24 5.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.17 -0.956 . . . . 0.0 110.341 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' ILE . . . . . 0.55 ' O ' ' CG1' ' B' ' 81' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.126 -0.984 . . . . 0.0 109.965 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.251 0.548 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.44 122.39 61.24 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.508 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -68.96 146.52 65.44 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.063 1.56 . . . . 0.0 110.197 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.422 ' CG1' ' O ' ' A' ' 4' ' ' ILE . 1.7 pp -143.98 117.38 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.168 -0.957 . . . . 0.0 110.364 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -94.13 153.38 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 109.999 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.557 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -134.96 117.59 15.96 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.0 109.85 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.66 148.65 35.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.311 -0.868 . . . . 0.0 110.199 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.516 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 16.6 tttm -142.72 168.1 20.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 110.225 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.516 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 151.11 -156.38 26.64 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.14 127.57 32.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.238 -1.154 . . . . 0.0 110.342 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.19 -27.03 5.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.099 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -77.75 -45.67 23.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.279 -0.888 . . . . 0.0 110.29 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.434 ' O ' HD11 ' A' ' 17' ' ' LEU . 28.2 m -57.89 -21.76 44.88 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.163 -0.961 . . . . 0.0 110.086 179.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.429 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 30.6 mt -76.62 -29.69 56.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.872 . . . . 0.0 110.343 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -60.18 -39.46 86.54 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.229 -0.919 . . . . 0.0 110.59 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -69.91 -40.31 75.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.249 -0.907 . . . . 0.0 110.7 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.434 HD11 ' O ' ' A' ' 13' ' ' THR . 14.5 mt -58.51 -49.55 76.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.143 -0.973 . . . . 0.0 110.334 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.577 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 46.6 ttt-85 -45.04 -37.86 4.45 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.184 -0.948 . . . . 0.0 110.796 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.443 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 87.5 t80 -64.56 -41.77 96.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.103 -0.998 . . . . 0.0 110.344 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -57.67 -36.5 72.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.0 109.871 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.577 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 5.8 m-30 -66.79 -18.12 65.22 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.093 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.443 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 28.2 mmtt -63.31 -48.24 78.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.954 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.5 mmtt -74.83 -23.88 58.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.41 ' HB3' HD13 ' A' ' 27' ' ' LEU . 36.7 m170 -95.23 33.92 1.49 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.967 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.536 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 21.2 p -56.75 -24.63 51.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.257 -0.902 . . . . 0.0 110.07 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.426 ' CG2' ' O ' ' A' ' 26' ' ' THR . 14.1 t -96.9 54.09 1.26 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 109.771 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.41 HD13 ' HB3' ' A' ' 24' ' ' HIS . 12.4 mt -147.78 -32.02 0.28 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -0.851 . . . . 0.0 110.755 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.536 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 9.2 p90 -108.76 167.51 10.01 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.928 -1.108 . . . . 0.0 110.012 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 m -100.66 -36.56 9.09 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.091 -1.006 . . . . 0.0 110.88 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.1 118.85 2.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.08 -1.013 . . . . 0.0 110.728 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -89.94 136.06 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.266 -0.896 . . . . 0.0 109.935 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.57 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 28.4 p -96.36 149.83 21.26 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.071 -1.018 . . . . 0.0 110.303 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.31 162.02 8.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.22 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -68.0 127.88 34.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.328 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.574 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 40.9 p-90 -146.14 179.95 7.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.198 -0.939 . . . . 0.0 109.798 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.579 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 26.7 t-80 -162.71 173.82 13.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.863 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.579 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 55.9 m95 -78.6 93.35 4.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.401 -0.812 . . . . 0.0 109.834 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.6 t -74.18 157.63 35.59 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.312 -0.868 . . . . 0.0 110.42 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -171.2 165.67 38.76 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -54.35 -45.18 72.67 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -1.21 . . . . 0.0 109.977 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -112.95 112.91 24.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.341 -0.849 . . . . 0.0 110.161 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -96.89 -167.23 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.228 -0.92 . . . . 0.0 109.789 -179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.4 tttt -131.35 -67.38 0.7 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.144 -0.973 . . . . 0.0 110.325 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -154.86 -158.59 0.86 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.923 . . . . 0.0 110.11 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -82.87 111.82 19.11 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -0.918 . . . . 0.0 110.186 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.483 ' O ' HG13 ' A' ' 48' ' ' ILE . 60.4 p -141.42 31.52 1.7 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.286 -0.884 . . . . 0.0 110.112 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.446 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -37.2 152.65 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.515 -0.741 . . . . 0.0 110.559 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.483 HG13 ' O ' ' A' ' 46' ' ' SER . 40.6 mt -142.49 146.86 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.892 . . . . 0.0 110.115 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.21 178.18 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.185 -0.947 . . . . 0.0 110.25 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.543 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 53.9 m -145.91 151.18 37.43 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.267 -0.896 . . . . 0.0 110.159 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.499 ' N ' HG22 ' A' ' 50' ' ' THR . 0.3 OUTLIER -135.72 128.91 31.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -0.998 . . . . 0.0 110.091 179.943 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -97.91 134.51 40.94 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.301 -0.874 . . . . 0.0 110.642 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.521 ' OH ' ' CG ' ' A' ' 62' ' ' PHE . 54.8 m-85 -112.72 151.51 30.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.298 -0.876 . . . . 0.0 110.053 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -76.7 -8.52 57.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 110.622 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.8 p -169.55 160.94 9.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.05 -1.031 . . . . 0.0 110.561 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.2 -41.94 80.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.203 -0.936 . . . . 0.0 109.932 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.48 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 51.7 t-105 -53.51 -52.39 59.77 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.472 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 61.7 tt0 -58.74 -30.56 67.59 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.188 -0.945 . . . . 0.0 109.685 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.1 -48.97 79.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.392 -0.817 . . . . 0.0 110.557 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.537 ' OD1' ' N ' ' A' ' 61' ' ' GLN . 2.5 p30 -61.17 -26.54 67.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.087 -1.008 . . . . 0.0 110.315 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.537 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 67.1 mt-30 -65.95 -52.03 53.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.151 -0.968 . . . . 0.0 109.97 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.521 ' CG ' ' OH ' ' A' ' 53' ' ' TYR . 5.7 t80 -55.53 -46.32 77.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 109.718 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.3 mt -59.75 -21.87 61.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.33 -0.856 . . . . 0.0 110.198 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.91 -17.56 29.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 110.076 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -94.65 -14.74 24.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.312 -0.867 . . . . 0.0 110.351 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.4 HG21 ' CZ ' ' A' ' 62' ' ' PHE . 20.1 m -130.37 134.81 61.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -0.908 . . . . 0.0 110.137 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.5 tptp -86.52 120.05 27.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.205 -0.934 . . . . 0.0 110.322 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.433 ' O ' ' C ' ' A' ' 69' ' ' PRO . 4.8 mm -88.96 103.6 5.94 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.967 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.533 ' HG2' ' CG1' ' A' ' 72' ' ' ILE . 46.0 Cg_endo -39.9 154.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.094 1.576 . . . . 0.0 110.418 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.413 ' HB3' ' HE3' ' A' ' 70' ' ' LYS . 13.6 mtpp -70.35 -14.86 62.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 0.0 110.459 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -84.66 -19.32 33.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.361 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.533 ' CG1' ' HG2' ' A' ' 69' ' ' PRO . 23.8 mt -93.81 123.59 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.6 m -94.7 136.6 34.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.458 -0.776 . . . . 0.0 110.416 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.48 HG11 ' N ' ' A' ' 75' ' ' SER . 92.9 t -90.73 171.99 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.565 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.557 ' HB2' ' CB ' ' A' ' 6' ' ' HIS . 0.4 OUTLIER -142.45 152.82 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.387 -0.821 . . . . 0.0 110.661 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.438 ' O ' ' HB3' ' B' ' 80' ' ' SER . 63.5 p -132.97 135.4 45.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.273 -0.892 . . . . 0.0 110.15 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.502 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -174.39 -173.63 40.53 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.502 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 50.2 m-85 -147.65 151.56 36.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.167 -1.196 . . . . 0.0 110.399 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.439 ' CE ' ' HE1' ' B' ' 79' ' ' MET . 25.5 mtt -119.78 174.84 6.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.182 -0.949 . . . . 0.0 110.287 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.453 ' C ' ' CG1' ' A' ' 81' ' ' ILE . 0.1 OUTLIER -140.69 108.72 5.73 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.324 -0.86 . . . . 0.0 109.836 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.453 ' CG1' ' C ' ' A' ' 80' ' ' SER . 23.3 mt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.23 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mtm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.226 0.536 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.5 122.17 61.64 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.161 -0.962 . . . . 0.0 110.44 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.5 Cg_endo -68.79 146.86 67.62 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.978 1.515 . . . . 0.0 110.071 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.417 HD11 ' O ' ' B' ' 4' ' ' ILE . 1.7 pp -144.12 117.22 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.118 -0.989 . . . . 0.0 110.297 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 53.6 t -94.06 152.63 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.268 -0.895 . . . . 0.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.581 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 0.0 OUTLIER -134.45 117.75 16.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.938 179.9 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -113.86 148.81 36.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.284 -179.791 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.502 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 16.5 tttm -142.59 168.34 19.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.502 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 151.12 -156.76 26.84 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 53.5 m-20 -64.98 127.31 31.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -1.188 . . . . 0.0 110.293 179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.09 -26.86 4.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.299 -0.876 . . . . 0.0 110.088 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -77.6 -45.92 23.74 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.19 -0.944 . . . . 0.0 110.219 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.439 ' O ' HD11 ' B' ' 17' ' ' LEU . 28.1 m -57.96 -21.13 42.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.26 -0.9 . . . . 0.0 110.089 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.448 ' HA ' ' CD1' ' B' ' 17' ' ' LEU . 31.7 mt -77.24 -29.79 54.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.247 -0.908 . . . . 0.0 110.246 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -60.13 -38.84 84.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.879 . . . . 0.0 110.582 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.7 t -70.02 -40.19 75.35 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.192 -0.943 . . . . 0.0 110.8 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.448 ' CD1' ' HA ' ' B' ' 14' ' ' LEU . 14.0 mt -58.86 -50.13 75.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.128 -0.982 . . . . 0.0 110.349 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.568 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 46.5 ttt-85 -44.8 -37.26 3.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.924 . . . . 0.0 110.767 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.448 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 87.7 t80 -64.97 -41.56 95.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.991 -1.068 . . . . 0.0 110.239 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 mtt180 -58.21 -36.6 73.37 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.212 -0.93 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.568 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 5.8 m-30 -66.54 -17.8 65.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . 0.448 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.1 mmtt -63.39 -48.54 77.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.203 -0.936 . . . . 0.0 110.035 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -74.66 -23.81 58.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.264 -0.898 . . . . 0.0 109.638 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.409 ' HB3' ' CD1' ' B' ' 27' ' ' LEU . 36.2 m170 -95.23 34.05 1.47 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.347 -0.846 . . . . 0.0 109.832 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.51 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.2 p -56.74 -24.84 52.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.309 -0.87 . . . . 0.0 110.015 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.43 ' O ' ' CG2' ' B' ' 26' ' ' THR . 14.0 t -96.71 54.06 1.29 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.35 -0.844 . . . . 0.0 109.77 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.409 ' CD1' ' HB3' ' B' ' 24' ' ' HIS . 12.3 mt -147.76 -32.02 0.28 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.335 -0.853 . . . . 0.0 110.788 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.51 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 9.1 p90 -108.38 167.53 9.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.864 -1.148 . . . . 0.0 110.04 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 18.9 m -100.54 -36.88 9.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.193 -0.942 . . . . 0.0 110.698 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.87 118.93 2.8 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.054 -1.029 . . . . 0.0 110.733 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -89.95 136.81 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.296 -0.877 . . . . 0.0 109.827 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.574 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 26.8 p -97.37 150.46 20.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.135 -0.978 . . . . 0.0 110.451 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.36 161.74 8.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.368 -0.833 . . . . 0.0 110.43 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -68.15 127.55 33.31 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 110.365 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.57 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 39.8 p-90 -146.26 -179.97 7.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.66 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.575 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 27.5 t-80 -162.57 174.37 12.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.931 -1.105 . . . . 0.0 110.67 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.575 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 57.1 m95 -78.6 93.54 4.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.484 -0.76 . . . . 0.0 109.806 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 13.9 t -73.73 157.68 36.04 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.27 -0.894 . . . . 0.0 110.333 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -171.54 166.36 39.37 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.333 -1.507 . . . . 0.0 109.333 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -55.98 -43.91 78.06 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.229 -1.16 . . . . 0.0 110.132 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -114.24 111.6 21.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.235 -0.915 . . . . 0.0 110.061 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.25 -167.56 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.281 -0.887 . . . . 0.0 110.028 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -130.57 -68.44 0.69 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.213 -0.93 . . . . 0.0 110.233 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -153.78 -157.74 0.8 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.241 -0.912 . . . . 0.0 110.127 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -83.6 111.22 18.91 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.221 -0.925 . . . . 0.0 110.176 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.484 ' O ' HG13 ' B' ' 48' ' ' ILE . 61.8 p -140.73 32.25 1.82 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.32 -0.862 . . . . 0.0 110.234 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.461 ' C ' ' O ' ' B' ' 46' ' ' SER . . . -37.94 152.91 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.488 -0.757 . . . . 0.0 110.66 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.484 HG13 ' O ' ' B' ' 46' ' ' SER . 38.7 mt -142.75 147.24 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 110.125 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.95 178.26 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.219 -0.926 . . . . 0.0 110.281 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.581 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 53.1 m -145.96 151.75 38.3 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.246 -0.909 . . . . 0.0 110.105 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.507 ' N ' HG22 ' B' ' 50' ' ' THR . 0.3 OUTLIER -136.08 129.12 31.4 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.159 -0.963 . . . . 0.0 110.061 179.863 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 7.3 m -97.95 134.58 40.87 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.28 -0.888 . . . . 0.0 110.602 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.51 ' OH ' ' CG ' ' B' ' 62' ' ' PHE . 52.8 m-85 -112.84 151.6 30.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.315 -0.865 . . . . 0.0 110.065 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -76.31 -9.2 58.46 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.191 -0.943 . . . . 0.0 110.637 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 26.1 p -169.51 160.19 8.95 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.186 -0.946 . . . . 0.0 110.468 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.81 -42.15 86.37 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.196 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . 0.482 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 50.4 t-105 -53.53 -52.34 59.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.243 -0.911 . . . . 0.0 109.669 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.467 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 63.1 tt0 -58.85 -30.11 67.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.243 -0.911 . . . . 0.0 109.721 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.29 -49.18 78.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 110.464 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' B' ' 61' ' ' GLN . 2.3 p30 -61.18 -26.61 67.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.093 -1.005 . . . . 0.0 110.36 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.53 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 67.2 mt-30 -65.86 -52.09 53.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.19 -0.944 . . . . 0.0 109.851 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.51 ' CG ' ' OH ' ' B' ' 53' ' ' TYR . 5.3 t80 -55.47 -46.3 76.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.824 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.2 mt -59.59 -22.07 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.0 110.136 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.71 -17.62 29.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.146 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -94.68 -13.96 25.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.293 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.403 HG21 ' CZ ' ' B' ' 62' ' ' PHE . 22.0 m -131.01 134.63 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.188 -0.945 . . . . 0.0 110.181 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -86.3 120.03 27.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.43 ' O ' ' C ' ' B' ' 69' ' ' PRO . 4.9 mm -89.02 103.76 6.3 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.979 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.529 ' HG2' ' CG1' ' B' ' 72' ' ' ILE . 45.8 Cg_endo -40.38 154.5 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.076 1.566 . . . . 0.0 110.495 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -70.5 -14.76 62.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.886 . . . . 0.0 110.486 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 28.4 m -84.58 -19.05 33.7 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.154 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.529 ' CG1' ' HG2' ' B' ' 69' ' ' PRO . 27.1 mt -94.32 123.71 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.33 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 24.3 m -94.8 136.64 34.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.38 -0.825 . . . . 0.0 110.495 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.485 HG11 ' N ' ' B' ' 75' ' ' SER . 99.4 t -90.79 172.07 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.264 -0.898 . . . . 0.0 110.602 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' SER . . . . . 0.561 ' HB2' ' CB ' ' B' ' 6' ' ' HIS . 0.4 OUTLIER -142.29 153.56 44.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.358 -0.839 . . . . 0.0 110.658 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' THR . . . . . 0.443 ' O ' ' HB3' ' A' ' 80' ' ' SER . 52.5 p -133.56 135.74 44.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . 0.529 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -174.61 -173.61 40.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.529 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 48.9 m-85 -147.81 149.92 33.24 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -1.117 . . . . 0.0 110.33 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.439 ' HE1' ' CE ' ' A' ' 79' ' ' MET . 26.0 mtt -118.69 173.22 6.98 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.226 -0.921 . . . . 0.0 110.351 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.454 ' C ' HG13 ' B' ' 81' ' ' ILE . 0.1 OUTLIER -139.43 107.95 5.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 110.086 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.484 HD13 ' OG ' ' A' ' 75' ' ' SER . 29.7 mt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.169 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.4 mmm . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.327 0.584 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.43 ' O ' ' CG2' ' A' ' 2' ' ' THR . 14.8 t -88.42 125.96 61.84 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.903 . . . . 0.0 110.413 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.559 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -63.45 152.29 80.81 Favored 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 124.124 1.592 . . . . 0.0 110.209 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.447 HG22 ' C ' ' A' ' 3' ' ' PRO . 11.1 pt -144.16 164.04 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.211 -0.931 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.471 ' O ' HG22 ' A' ' 50' ' ' THR . 41.3 t -146.14 136.88 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.159 -0.963 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.594 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 0.3 OUTLIER -105.2 131.38 52.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 109.599 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.473 ' O ' HG22 ' A' ' 48' ' ' ILE . 0.4 OUTLIER -122.45 139.66 53.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.139 -0.976 . . . . 0.0 110.771 -179.407 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.489 ' CG ' ' N ' ' A' ' 9' ' ' GLY . 80.6 tttt -142.3 170.85 14.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 110.164 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.489 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 153.44 -160.55 29.28 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.619 -1.393 . . . . 0.0 109.619 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.45 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 47.0 t0 -64.86 130.54 43.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -1.143 . . . . 0.0 110.336 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.1 -30.77 11.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.302 -0.873 . . . . 0.0 110.464 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -83.61 -48.39 10.26 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.263 -0.898 . . . . 0.0 110.527 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.45 ' HB ' ' HB3' ' A' ' 10' ' ' ASP . 91.7 m -57.88 -14.96 7.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 110.494 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.457 ' HA ' HD11 ' A' ' 17' ' ' LEU . 64.2 mt -82.48 -32.42 28.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 110.309 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -59.23 -36.62 75.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.239 -0.913 . . . . 0.0 110.031 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.422 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.7 t -70.11 -34.67 73.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.288 -0.883 . . . . 0.0 110.048 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.457 HD11 ' HA ' ' A' ' 14' ' ' LEU . 13.3 mt -58.77 -50.62 73.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.917 . . . . 0.0 109.939 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.562 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 34.5 ttt180 -46.23 -30.65 2.09 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.283 -0.885 . . . . 0.0 109.883 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.474 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 28.2 t80 -65.01 -46.55 80.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.399 -0.813 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -34.29 73.63 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.225 -0.922 . . . . 0.0 110.316 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.562 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.5 m-30 -66.38 -22.6 66.25 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 110.377 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.474 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 29.5 mmtt -63.62 -29.93 71.11 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.244 -0.91 . . . . 0.0 110.336 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -74.84 -47.75 28.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.464 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 16.0 m-70 -95.15 41.3 1.1 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.869 . . . . 0.0 109.965 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.547 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 24.5 p -56.8 -19.15 15.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 110.19 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 89.7 m -97.17 6.43 48.48 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.327 -0.858 . . . . 0.0 110.284 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.464 ' HB2' ' HB3' ' A' ' 24' ' ' HIS . 0.8 OUTLIER -92.19 -7.67 47.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.291 -0.88 . . . . 0.0 110.187 -179.754 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.547 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 7.3 p90 -141.7 -176.76 4.88 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.027 -179.607 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.3 m -94.84 -62.83 1.25 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.921 . . . . 0.0 109.191 179.911 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.18 143.86 18.25 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.929 -1.107 . . . . 0.0 108.72 -179.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.467 HG11 ' O ' ' A' ' 31' ' ' VAL . 7.7 p -90.02 110.76 22.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.9 0 O-C-N 121.639 -0.663 . . . . 0.0 110.325 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.585 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -53.24 146.15 12.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.213 -0.929 . . . . 0.0 110.009 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.557 ' HB2' ' CG2' ' B' ' 38' ' ' THR . 7.0 t -60.9 160.82 9.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 m -67.75 122.07 17.31 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.525 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.579 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 25.4 p-90 -147.1 166.7 26.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 109.83 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.516 ' CD2' HG13 ' A' ' 48' ' ' ILE . 11.2 t-80 -162.58 -173.52 3.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.042 -1.036 . . . . 0.0 110.779 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.583 ' CH2' HG23 ' B' ' 52' ' ' THR . 19.4 m95 -79.53 101.67 8.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.501 -0.75 . . . . 0.0 110.379 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.546 ' CG2' ' HB2' ' B' ' 33' ' ' SER . 1.7 t -153.47 141.12 19.95 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.401 -0.812 . . . . 0.0 110.017 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.35 -34.21 84.48 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.903 -1.279 . . . . 0.0 109.903 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.432 ' O ' ' HB2' ' A' ' 41' ' ' ASN . 0.0 OUTLIER 179.7 -29.46 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.091 -1.24 . . . . 0.0 110.177 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.432 ' HB2' ' O ' ' A' ' 40' ' ' HIS . 8.5 t-20 -176.78 113.12 0.1 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.222 -0.923 . . . . 0.0 109.847 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -128.66 -179.14 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.231 -0.918 . . . . 0.0 110.58 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.467 ' O ' ' C ' ' A' ' 44' ' ' HIS . 25.5 mttt -86.79 -49.73 7.24 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.426 -0.796 . . . . 0.0 110.637 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.467 ' C ' ' O ' ' A' ' 43' ' ' LYS . 1.8 m80 -36.75 140.94 0.13 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.357 -0.839 . . . . 0.0 110.621 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.6 mttp -81.83 42.06 0.69 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.417 -0.802 . . . . 0.0 110.723 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.486 ' CB ' ' ND1' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -54.04 141.2 29.17 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.104 -0.997 . . . . 0.0 109.999 179.821 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -170.6 117.91 0.51 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.147 -0.971 . . . . 0.0 110.475 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.516 HG13 ' CD2' ' A' ' 36' ' ' HIS . 2.7 mt -140.55 155.6 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.275 -0.891 . . . . 0.0 110.297 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.9 t -138.75 118.47 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.385 -0.822 . . . . 0.0 110.394 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.594 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 86.9 m -94.3 158.13 15.72 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.251 -0.905 . . . . 0.0 110.314 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.97 134.24 38.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.274 -0.892 . . . . 0.0 110.112 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.523 HG23 ' CH2' ' B' ' 37' ' ' TRP . 0.9 OUTLIER -96.38 123.94 40.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.228 -0.92 . . . . 0.0 110.341 -179.903 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.559 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 58.5 m-85 -103.32 146.83 27.88 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.351 -0.843 . . . . 0.0 109.85 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.09 -8.25 58.81 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.203 -0.935 . . . . 0.0 110.658 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.9 p -171.15 134.11 0.9 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.961 . . . . 0.0 110.374 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.501 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 44.4 mt-10 -50.08 -37.54 34.16 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.249 -0.907 . . . . 0.0 109.988 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 35.5 t-105 -53.83 -58.87 5.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.076 -1.015 . . . . 0.0 109.799 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -58.47 -28.74 65.62 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.161 -0.962 . . . . 0.0 110.337 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.501 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 53.6 ttp180 -59.56 -48.38 81.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.154 -0.967 . . . . 0.0 110.984 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.519 ' OD1' ' N ' ' A' ' 61' ' ' GLN . 1.1 p30 -60.93 -33.67 73.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.093 -1.004 . . . . 0.0 110.741 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.519 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 57.5 mt-30 -65.65 -47.57 75.12 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.148 -0.97 . . . . 0.0 110.271 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.486 ' CD1' ' OH ' ' A' ' 53' ' ' TYR . 36.2 t80 -55.8 -65.24 0.63 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.38 -0.825 . . . . 0.0 110.664 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.468 HD21 ' HA ' ' A' ' 60' ' ' ASP . 3.0 pp -59.39 -18.33 37.88 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 3.6 t -81.84 -20.68 38.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 0.0 110.128 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.52 -73.03 0.6 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.273 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 34.3 m -48.14 130.18 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.113 -0.992 . . . . 0.0 109.992 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.7 108.43 6.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.179 -0.95 . . . . 0.0 110.492 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 30.9 mt -89.21 121.37 69.54 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.377 -0.827 . . . . 0.0 110.09 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -56.26 179.01 0.1 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 123.899 1.473 . . . . 0.0 110.528 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -92.19 -12.43 32.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 110.133 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.3 m -84.62 -16.69 41.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.249 -0.907 . . . . 0.0 110.305 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.522 ' N ' ' CD1' ' A' ' 72' ' ' ILE . 1.2 mp -94.06 119.39 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.243 -0.911 . . . . 0.0 110.041 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.56 139.75 30.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.32 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 8.4 p -90.71 170.54 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.245 -0.909 . . . . 0.0 110.46 -179.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.586 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.2 OUTLIER -143.85 158.84 43.42 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.345 -0.847 . . . . 0.0 110.988 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.445 ' O ' ' OG ' ' B' ' 80' ' ' SER . 69.7 p -133.37 134.19 43.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.39 -0.819 . . . . 0.0 109.854 179.261 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -167.75 -168.22 29.56 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -147.78 149.15 31.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.232 -1.158 . . . . 0.0 110.334 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.424 ' HE3' HG23 ' A' ' 81' ' ' ILE . 24.5 mmm -124.75 154.48 40.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 110.092 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.471 ' O ' HG21 ' A' ' 81' ' ' ILE . 0.7 OUTLIER -130.23 103.86 6.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -0.963 . . . . 0.0 110.394 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.471 HG21 ' O ' ' A' ' 80' ' ' SER . 13.2 pt . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.194 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.6 mmm . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.173 0.511 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.432 ' O ' ' CG2' ' B' ' 2' ' ' THR . 14.7 t -88.65 125.42 63.14 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.269 -0.894 . . . . 0.0 110.48 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.558 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.1 Cg_endo -63.35 152.27 80.78 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.051 1.553 . . . . 0.0 110.408 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.432 HG22 ' C ' ' B' ' 3' ' ' PRO . 10.3 pt -144.12 164.39 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.232 -0.918 . . . . 0.0 110.397 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.447 ' O ' HG22 ' B' ' 50' ' ' THR . 41.5 t -146.32 137.27 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.269 -0.895 . . . . 0.0 110.437 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.602 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.3 OUTLIER -105.4 131.0 53.37 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.349 -0.844 . . . . 0.0 109.582 179.585 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.481 ' O ' HG22 ' B' ' 48' ' ' ILE . 0.4 OUTLIER -122.22 139.85 53.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.065 -1.022 . . . . 0.0 110.703 -179.408 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.483 ' CG ' ' N ' ' B' ' 9' ' ' GLY . 80.5 tttt -142.35 170.43 15.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 110.176 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.483 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 153.81 -160.5 29.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . 0.461 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 45.8 t0 -64.94 130.98 45.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -1.139 . . . . 0.0 110.372 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.33 -30.93 13.18 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.311 -0.868 . . . . 0.0 110.388 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -83.92 -48.25 10.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.264 -0.898 . . . . 0.0 110.508 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.438 ' HB ' ' HB3' ' B' ' 10' ' ' ASP . 99.2 m -57.78 -14.57 6.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.462 ' HA ' HD11 ' B' ' 17' ' ' LEU . 70.4 mt -83.04 -32.22 26.99 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.313 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -59.53 -35.91 75.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.156 -0.965 . . . . 0.0 110.065 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.428 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.7 t -70.46 -34.82 72.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.198 -0.939 . . . . 0.0 110.108 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.462 HD11 ' HA ' ' B' ' 14' ' ' LEU . 13.6 mt -58.84 -50.77 72.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 0.0 110.164 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.576 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 33.1 ttt180 -46.29 -30.19 1.95 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.293 -0.88 . . . . 0.0 109.903 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.478 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 30.0 t80 -65.06 -47.3 77.8 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.405 -0.809 . . . . 0.0 110.319 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.71 -33.9 72.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.209 -0.932 . . . . 0.0 110.27 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.576 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.4 m-30 -66.72 -22.87 66.05 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.0 110.293 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.7 mmtt -63.37 -30.02 71.22 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.95 . . . . 0.0 110.412 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -74.92 -48.04 26.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.195 -0.941 . . . . 0.0 110.052 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.486 ' HB3' ' HB2' ' B' ' 27' ' ' LEU . 15.8 m-70 -94.82 41.63 1.09 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.269 -0.894 . . . . 0.0 110.063 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.536 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 25.2 p -57.04 -18.87 15.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.336 -0.853 . . . . 0.0 110.14 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 86.8 m -97.27 6.11 48.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.858 . . . . 0.0 110.199 179.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.486 ' HB2' ' HB3' ' B' ' 24' ' ' HIS . 0.7 OUTLIER -92.26 -6.2 50.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.224 -0.922 . . . . 0.0 110.324 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.536 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 7.6 p90 -143.29 -177.1 5.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.372 -0.83 . . . . 0.0 109.836 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.3 m -94.8 -63.23 1.2 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.244 -0.91 . . . . 0.0 109.214 -179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -156.8 143.09 18.17 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 120.985 -1.072 . . . . 0.0 108.625 -179.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.472 HG11 ' O ' ' B' ' 31' ' ' VAL . 7.5 p -89.95 110.77 22.29 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 110.268 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.579 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -52.7 145.84 11.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.4 -0.812 . . . . 0.0 110.195 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' SER . . . . . 0.546 ' HB2' ' CG2' ' A' ' 38' ' ' THR . 6.8 t -60.66 160.86 8.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.284 -0.885 . . . . 0.0 110.102 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -67.99 122.73 18.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -0.901 . . . . 0.0 110.38 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.585 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 26.1 p-90 -147.76 167.02 25.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.618 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.482 ' ND1' ' CB ' ' B' ' 46' ' ' SER . 12.3 t-80 -162.61 -173.66 3.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.019 -1.051 . . . . 0.0 110.815 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.523 ' CH2' HG23 ' A' ' 52' ' ' THR . 19.9 m95 -79.43 100.79 7.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.535 -0.728 . . . . 0.0 110.379 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' THR . . . . . 0.557 ' CG2' ' HB2' ' A' ' 33' ' ' SER . 1.4 t -151.7 142.28 22.68 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.388 -0.82 . . . . 0.0 110.241 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -68.06 -34.2 80.85 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . 0.428 ' CE1' ' HB2' ' B' ' 41' ' ' ASN . 0.0 OUTLIER 179.38 -31.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.295 -1.121 . . . . 0.0 109.734 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . 0.428 ' HB2' ' CE1' ' B' ' 40' ' ' HIS . 7.9 t-20 -174.98 115.18 0.16 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.332 -0.855 . . . . 0.0 109.863 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.3 -178.82 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.243 -0.91 . . . . 0.0 110.197 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.475 ' O ' ' C ' ' B' ' 44' ' ' HIS . 26.1 mttt -87.56 -49.69 7.01 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.287 -0.883 . . . . 0.0 110.611 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . 0.475 ' C ' ' O ' ' B' ' 43' ' ' LYS . 1.8 m80 -36.07 140.92 0.11 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.478 -0.764 . . . . 0.0 110.574 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -82.28 44.04 0.84 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.351 -0.843 . . . . 0.0 110.579 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.482 ' CB ' ' ND1' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -55.97 140.45 43.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.179 -0.951 . . . . 0.0 109.811 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -169.96 117.88 0.58 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.204 -0.935 . . . . 0.0 110.596 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.481 HG13 ' CD2' ' B' ' 36' ' ' HIS . 2.5 mt -140.49 155.75 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 110.338 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 62.1 t -138.57 117.89 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.591 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 93.9 m -93.77 158.49 15.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.208 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.33 134.42 37.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.973 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.583 HG23 ' CH2' ' A' ' 37' ' ' TRP . 0.8 OUTLIER -96.5 124.63 40.55 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.223 -0.923 . . . . 0.0 110.47 -179.819 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.558 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -104.09 146.79 28.22 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.335 -0.853 . . . . 0.0 109.887 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -79.17 -8.23 58.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.16 -0.963 . . . . 0.0 110.487 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 84.3 p -170.71 135.01 1.09 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.203 -0.935 . . . . 0.0 110.252 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.504 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 42.9 mt-10 -51.17 -37.43 46.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.965 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . 0.481 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 35.3 t-105 -53.82 -58.57 6.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.124 -0.985 . . . . 0.0 109.81 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -58.78 -28.54 66.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.173 -0.954 . . . . 0.0 110.327 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.504 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 54.0 ttp180 -59.47 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.143 -0.973 . . . . 0.0 110.853 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.516 ' OD1' ' N ' ' B' ' 61' ' ' GLN . 1.1 p30 -61.04 -33.76 73.79 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.056 -1.027 . . . . 0.0 110.785 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.516 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 56.7 mt-30 -65.78 -47.26 75.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.062 -1.024 . . . . 0.0 110.122 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.497 ' CD1' ' OH ' ' B' ' 53' ' ' TYR . 37.2 t80 -55.88 -65.49 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 110.646 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.471 HD21 ' HA ' ' B' ' 60' ' ' ASP . 2.9 pp -59.13 -18.85 39.47 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.352 -0.842 . . . . 0.0 110.426 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 3.3 t -81.54 -20.32 40.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.127 -0.983 . . . . 0.0 110.171 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.68 -73.5 0.59 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.105 -0.997 . . . . 0.0 110.244 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 34.0 m -47.54 130.17 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.212 -0.93 . . . . 0.0 109.937 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.53 108.7 6.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.173 -0.954 . . . . 0.0 110.426 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 25.1 mt -89.47 121.89 68.86 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.011 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 47.1 Cg_endo -57.0 178.55 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 123.968 1.509 . . . . 0.0 110.557 -179.79 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -91.75 -12.34 34.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.206 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.1 m -84.76 -16.79 40.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.212 -0.93 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.52 ' N ' ' CD1' ' B' ' 72' ' ' ILE . 1.2 mp -93.96 119.14 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.147 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.43 139.69 30.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.328 -0.857 . . . . 0.0 110.175 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 8.4 p -90.6 170.69 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 110.518 -179.383 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' SER . . . . . 0.602 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.87 158.53 43.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.432 -0.792 . . . . 0.0 111.008 179.823 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 82.8 p -133.34 134.21 43.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.453 -0.779 . . . . 0.0 109.97 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -168.21 -167.84 29.45 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -147.81 149.45 32.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.1 -1.235 . . . . 0.0 110.507 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.438 ' HE3' ' CG2' ' B' ' 81' ' ' ILE . 24.1 mmm -125.09 153.18 43.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.169 -0.957 . . . . 0.0 110.017 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.469 ' O ' HG21 ' B' ' 81' ' ' ILE . 0.7 OUTLIER -128.89 104.41 7.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.211 -0.931 . . . . 0.0 110.24 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.469 HG21 ' O ' ' B' ' 80' ' ' SER . 13.7 pt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.181 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 mtm . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.171 0.51 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.72 118.09 66.85 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.175 -0.953 . . . . 0.0 110.15 179.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.511 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 50.6 Cg_endo -53.54 147.0 40.37 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.093 1.575 . . . . 0.0 110.411 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 3' ' ' PRO . 1.1 pt -143.06 109.93 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.34 -0.85 . . . . 0.0 110.024 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.414 HG11 HD11 ' A' ' 7' ' ' LEU . 48.9 t -93.95 153.92 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 110.424 -179.978 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.566 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 0.0 OUTLIER -134.71 117.14 15.7 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.372 -0.83 . . . . 0.0 109.821 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.414 HD11 HG11 ' A' ' 5' ' ' VAL . 0.8 OUTLIER -112.74 145.36 40.68 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 -179.716 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.454 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 20.4 tttm -143.42 169.8 16.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.265 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.79 -157.35 27.24 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.472 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 81.9 m-20 -64.79 123.5 19.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.179 -1.189 . . . . 0.0 109.948 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.415 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -49.77 -43.94 48.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.842 . . . . 0.0 110.632 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.42 -48.22 82.68 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.241 -0.912 . . . . 0.0 110.451 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.4 m -57.96 -28.19 64.12 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.301 -0.874 . . . . 0.0 110.419 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.472 ' HG ' ' O ' ' A' ' 10' ' ' ASP . 97.5 mt -65.69 -30.03 70.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.214 -0.929 . . . . 0.0 110.042 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.1 -36.92 78.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.32 -0.862 . . . . 0.0 110.147 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.526 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 4.6 t -70.06 -40.56 75.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 110.762 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.492 HD12 ' CD1' ' A' ' 72' ' ' ILE . 1.0 OUTLIER -58.75 -52.03 67.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.973 -1.079 . . . . 0.0 110.188 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.515 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 7.3 ttt-85 -48.31 -27.6 2.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.886 . . . . 0.0 110.258 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.526 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 64.6 t80 -64.65 -25.74 68.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.224 -0.922 . . . . 0.0 110.074 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -83.55 -25.33 31.07 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.228 -0.92 . . . . 0.0 109.919 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.565 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 9.2 m-30 -66.5 -22.62 66.18 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.387 -0.821 . . . . 0.0 110.439 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -63.32 -47.35 82.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.06 -20.26 59.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.189 -0.944 . . . . 0.0 109.839 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.456 ' HB3' ' CD1' ' A' ' 27' ' ' LEU . 20.8 m170 -95.42 39.67 1.12 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 110.161 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.493 ' SG ' ' N ' ' A' ' 26' ' ' THR . 19.3 p -57.06 -36.2 70.24 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.11 -0.994 . . . . 0.0 110.368 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.493 ' N ' ' SG ' ' A' ' 25' ' ' CYS . 8.7 t -97.27 67.04 2.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.134 -0.979 . . . . 0.0 110.543 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.528 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 10.0 mt -148.11 -43.95 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.258 -0.901 . . . . 0.0 110.074 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -107.11 170.25 8.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.208 -0.932 . . . . 0.0 109.725 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.34 -33.84 10.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.087 -1.008 . . . . 0.0 111.046 -179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.417 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -159.73 116.82 2.6 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.097 . . . . 0.0 110.924 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.419 HG11 ' O ' ' A' ' 31' ' ' VAL . 6.4 p -90.03 131.33 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 110.019 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.551 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 53.8 p -86.02 149.23 25.31 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.251 -0.905 . . . . 0.0 110.302 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.0 t -61.36 161.58 9.01 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.142 -0.974 . . . . 0.0 110.013 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.87 128.37 36.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.326 -0.859 . . . . 0.0 110.406 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.55 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 36.6 p-90 -146.36 -179.25 6.62 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.294 -0.879 . . . . 0.0 109.77 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.565 ' CE1' ' O ' ' A' ' 37' ' ' TRP . 7.5 t-80 -162.56 169.71 19.79 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.1 -1.0 . . . . 0.0 110.208 -179.535 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.565 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 56.4 m95 -79.07 110.01 13.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.212 -0.93 . . . . 0.0 110.159 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -75.95 -155.82 0.06 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.274 -0.891 . . . . 0.0 110.183 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.71 147.2 4.67 Favored Glycine 0 N--CA 1.488 2.124 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -49.43 -30.86 8.67 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.232 -1.157 . . . . 0.0 110.144 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -114.03 136.21 53.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.221 -0.925 . . . . 0.0 110.08 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -168.46 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.177 -0.952 . . . . 0.0 109.883 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -149.73 -70.47 0.19 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.149 -0.969 . . . . 0.0 110.453 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -147.23 -170.76 3.63 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.241 -0.912 . . . . 0.0 110.308 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 11.8 mttt -74.83 107.92 7.23 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.374 -0.829 . . . . 0.0 109.889 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.557 ' HB2' ' CD2' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -125.6 26.78 6.65 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -0.927 . . . . 0.0 110.356 -179.775 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.479 ' C ' ' O ' ' A' ' 46' ' ' SER . . . -35.99 145.69 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.493 -0.754 . . . . 0.0 110.516 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.507 ' CG1' ' O ' ' A' ' 46' ' ' SER . 10.0 mt -142.48 157.71 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.226 -0.921 . . . . 0.0 109.915 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -139.0 179.51 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.154 -0.966 . . . . 0.0 110.521 -179.885 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.566 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 49.2 m -145.65 153.77 41.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.391 -0.818 . . . . 0.0 109.571 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.507 ' N ' HG21 ' A' ' 50' ' ' THR . 0.3 OUTLIER -133.91 128.79 35.28 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.034 -1.042 . . . . 0.0 110.342 -179.688 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -96.98 127.13 42.64 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.368 -0.833 . . . . 0.0 110.168 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.522 ' OH ' ' CD2' ' A' ' 62' ' ' PHE . 53.8 m-85 -106.85 147.79 29.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.31 -0.869 . . . . 0.0 110.064 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -71.44 -6.02 37.2 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.847 . . . . 0.0 110.773 -179.602 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 p -175.84 174.51 2.15 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -1.0 . . . . 0.0 110.594 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.98 -44.98 45.18 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.317 -0.865 . . . . 0.0 110.353 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.505 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 67.0 t-105 -53.62 -50.09 66.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.175 -0.953 . . . . 0.0 109.916 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 53.9 tt0 -57.08 -39.56 75.21 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 110.586 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.521 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 6.4 ttp180 -59.26 -40.67 86.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.98 -1.075 . . . . 0.0 110.643 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.505 ' OD2' ' O ' ' A' ' 57' ' ' TRP . 0.0 OUTLIER -61.45 -39.61 91.48 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.096 -1.003 . . . . 0.0 110.749 -179.429 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.462 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 23.1 mt-30 -65.4 -44.12 88.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.226 -0.921 . . . . 0.0 110.481 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.522 ' CD2' ' OH ' ' A' ' 53' ' ' TYR . 86.2 t80 -55.3 -42.01 73.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.179 -0.951 . . . . 0.0 110.119 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.5 mt -59.61 -13.24 8.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.7 p -98.83 -14.87 19.47 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.194 -0.941 . . . . 0.0 110.423 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 4.5 mm-40 -96.48 -12.65 23.87 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.173 -0.954 . . . . 0.0 109.992 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 13.8 m -133.22 105.21 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.302 -0.874 . . . . 0.0 110.084 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -62.37 123.66 18.84 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 110.398 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.405 HG23 HD13 ' A' ' 68' ' ' ILE . 25.3 mm -88.95 113.45 56.1 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.293 -0.88 . . . . 0.0 110.266 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.441 ' HG2' ' CG1' ' A' ' 72' ' ' ILE . 44.3 Cg_endo -56.61 152.33 41.72 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.042 1.548 . . . . 0.0 110.499 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -68.75 -11.85 60.79 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.275 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.2 m -84.64 -24.89 28.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.198 -0.939 . . . . 0.0 109.974 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.492 ' CD1' HD12 ' A' ' 17' ' ' LEU . 12.3 mt -94.12 123.45 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.466 -0.771 . . . . 0.0 110.148 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -94.48 138.0 32.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.23 -0.919 . . . . 0.0 110.023 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -91.26 172.59 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.204 -0.935 . . . . 0.0 110.574 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.525 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.89 155.41 44.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.566 -0.708 . . . . 0.0 110.381 179.524 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.486 ' O ' ' HB3' ' B' ' 80' ' ' SER . 0.6 OUTLIER -133.19 136.13 45.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 110.186 179.26 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -176.39 -172.33 40.98 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -179.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.417 ' CA ' HG12 ' A' ' 4' ' ' ILE . 97.7 m-85 -148.14 155.18 41.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.09 -1.241 . . . . 0.0 110.64 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' B' ' 79' ' ' MET . 27.2 mtt -123.64 174.79 7.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.333 -0.855 . . . . 0.0 110.168 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.488 ' C ' ' CG1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -139.08 109.19 6.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 110.085 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.488 ' CG1' ' C ' ' A' ' 80' ' ' SER . 10.8 mt . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.173 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.1 mtm . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.276 0.56 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -94.07 118.07 67.19 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.319 -0.863 . . . . 0.0 110.078 179.927 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.505 ' O ' HG22 ' B' ' 4' ' ' ILE . 49.8 Cg_endo -53.9 147.61 41.42 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.942 1.496 . . . . 0.0 110.496 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.505 HG22 ' O ' ' B' ' 3' ' ' PRO . 1.1 pt -142.95 109.52 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.984 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -93.8 153.13 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.306 -0.871 . . . . 0.0 110.271 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.522 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 0.0 OUTLIER -134.13 117.17 16.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.332 -0.855 . . . . 0.0 109.952 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.467 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.8 OUTLIER -112.87 145.5 40.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.178 -0.951 . . . . 0.0 110.33 -179.785 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.465 ' HG3' HG12 ' B' ' 48' ' ' ILE . 19.9 tttm -143.46 169.76 17.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.294 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.71 -157.38 27.26 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . 0.477 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 81.8 m-20 -64.57 123.1 18.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.18 -1.188 . . . . 0.0 110.041 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.402 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.9 -43.24 49.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.297 -0.877 . . . . 0.0 110.571 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -60.48 -48.33 82.22 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.194 -0.941 . . . . 0.0 110.358 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.9 m -58.31 -28.42 65.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.452 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.477 ' HG ' ' O ' ' B' ' 10' ' ' ASP . 94.3 mt -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.905 . . . . 0.0 110.145 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -60.12 -36.96 78.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.3 -0.875 . . . . 0.0 110.19 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.526 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 4.7 t -70.0 -40.55 75.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 110.64 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.496 HD12 ' CD1' ' B' ' 72' ' ' ILE . 1.0 OUTLIER -58.83 -51.81 68.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.014 -1.054 . . . . 0.0 110.252 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.51 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 7.3 ttt-85 -48.29 -27.4 2.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.37 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.526 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 65.4 t80 -64.6 -26.33 68.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.277 -0.889 . . . . 0.0 110.15 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -82.89 -25.27 32.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.915 . . . . 0.0 109.943 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.575 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.3 m-30 -66.46 -23.04 66.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.359 -0.838 . . . . 0.0 110.425 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -63.21 -47.01 84.35 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.25 -0.906 . . . . 0.0 110.304 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.11 -20.71 59.31 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.179 -0.951 . . . . 0.0 109.859 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.453 ' HB3' ' CD1' ' B' ' 27' ' ' LEU . 20.7 m170 -95.11 40.01 1.11 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.462 -0.773 . . . . 0.0 110.072 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' B' ' 26' ' ' THR . 18.5 p -57.3 -36.49 71.13 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.91 . . . . 0.0 110.354 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.496 ' N ' ' SG ' ' B' ' 25' ' ' CYS . 7.0 t -97.21 67.05 2.13 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.149 -0.969 . . . . 0.0 110.582 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.538 ' O ' ' NE2' ' B' ' 58' ' ' GLN . 10.1 mt -148.16 -44.38 0.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.204 -0.935 . . . . 0.0 110.049 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -106.49 170.31 8.0 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.204 -0.935 . . . . 0.0 109.763 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -100.26 -33.95 10.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.021 -1.05 . . . . 0.0 111.005 -179.314 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.401 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -159.67 116.91 2.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.991 -1.068 . . . . 0.0 110.866 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.453 HG11 ' O ' ' B' ' 31' ' ' VAL . 6.9 p -90.11 130.1 39.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.262 -0.899 . . . . 0.0 109.935 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.55 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 57.6 p -84.58 149.37 25.92 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.223 -0.923 . . . . 0.0 110.295 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -61.45 162.22 8.34 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.088 -1.008 . . . . 0.0 110.219 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.98 127.85 34.36 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.896 . . . . 0.0 110.269 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.551 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 37.9 p-90 -146.14 -178.92 6.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.22 -0.925 . . . . 0.0 109.882 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.576 ' CE1' ' O ' ' B' ' 37' ' ' TRP . 7.9 t-80 -162.56 169.38 20.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.054 -1.029 . . . . 0.0 110.414 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.576 ' O ' ' CE1' ' B' ' 36' ' ' HIS . 58.1 m95 -79.07 110.15 14.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 109.903 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t -76.03 -155.69 0.06 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.225 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.84 145.79 4.43 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -48.19 -31.79 6.21 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.125 -1.221 . . . . 0.0 110.024 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -113.44 135.56 53.75 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.307 -0.87 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -117.65 -168.88 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.188 -0.945 . . . . 0.0 109.927 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -149.39 -70.37 0.2 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.451 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -147.29 -172.05 3.93 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.157 -0.964 . . . . 0.0 110.352 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -73.71 106.98 5.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.312 -0.868 . . . . 0.0 110.0 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.52 ' HB2' ' CD2' ' B' ' 36' ' ' HIS . 0.7 OUTLIER -124.97 27.55 6.69 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.195 -0.941 . . . . 0.0 110.492 -179.781 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.465 ' C ' ' O ' ' B' ' 46' ' ' SER . . . -36.74 145.87 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.447 -0.783 . . . . 0.0 110.621 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.505 ' CG1' ' O ' ' B' ' 46' ' ' SER . 9.2 mt -142.65 157.95 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.345 -0.847 . . . . 0.0 109.963 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -139.14 179.95 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.123 -0.985 . . . . 0.0 110.637 -179.751 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.522 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 54.5 m -145.9 153.07 40.44 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 109.811 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.494 ' N ' HG21 ' B' ' 50' ' ' THR . 0.3 OUTLIER -133.3 128.84 36.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.166 -0.959 . . . . 0.0 110.464 -179.76 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 4.7 m -97.12 126.92 42.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.371 -0.83 . . . . 0.0 110.246 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.506 ' CD2' ' HA ' ' B' ' 59' ' ' ARG . 56.6 m-85 -106.87 148.17 28.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.258 -0.901 . . . . 0.0 110.013 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -72.15 -6.41 42.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.805 -179.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 p -174.81 174.89 2.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.064 -1.023 . . . . 0.0 110.264 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -75.91 -44.14 41.75 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 67.0 t-105 -53.64 -49.95 66.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.881 . . . . 0.0 110.197 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.0 tt0 -57.3 -39.39 75.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.22 -0.925 . . . . 0.0 110.645 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.506 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 6.3 ttp180 -59.29 -41.35 88.75 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.138 -0.976 . . . . 0.0 110.714 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.485 ' OD2' ' O ' ' B' ' 57' ' ' TRP . 0.0 OUTLIER -61.19 -39.18 89.22 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.124 -0.985 . . . . 0.0 110.741 -179.386 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.452 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 23.3 mt-30 -65.42 -44.24 87.97 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.089 -1.007 . . . . 0.0 110.437 -179.495 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.463 ' CD2' ' OH ' ' B' ' 53' ' ' TYR . 83.7 t80 -55.28 -41.8 72.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.137 -0.977 . . . . 0.0 109.935 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.0 mt -59.68 -12.56 7.18 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.246 -0.909 . . . . 0.0 110.176 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 12.3 p -99.5 -14.79 18.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.228 -0.92 . . . . 0.0 110.488 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . 0.468 ' HA ' ' OE1' ' B' ' 65' ' ' GLN . 4.5 mm-40 -96.45 -12.68 23.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 110.113 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 13.1 m -133.26 104.65 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.351 -0.843 . . . . 0.0 110.171 -179.903 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.6 tptp -62.0 123.86 19.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.428 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.401 HG23 HD13 ' B' ' 68' ' ' ILE . 25.3 mm -88.95 113.42 55.98 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.288 -0.883 . . . . 0.0 110.298 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.452 ' HG2' HG13 ' B' ' 72' ' ' ILE . 45.0 Cg_endo -56.4 152.6 38.73 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.957 1.504 . . . . 0.0 110.423 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -69.29 -11.86 61.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.219 -0.926 . . . . 0.0 110.29 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 10.7 m -84.48 -24.63 29.35 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.252 -0.905 . . . . 0.0 109.882 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.496 ' CD1' HD12 ' B' ' 17' ' ' LEU . 12.2 mt -94.37 123.41 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.275 -0.89 . . . . 0.0 110.267 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 99.1 m -94.53 138.07 32.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.163 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.7 t -91.32 172.49 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.413 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' SER . . . . . 0.506 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -143.09 155.65 44.65 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.517 -0.74 . . . . 0.0 110.346 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' THR . . . . . 0.464 ' O ' ' HB3' ' A' ' 80' ' ' SER . 0.6 OUTLIER -133.41 135.63 44.74 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.18 -0.95 . . . . 0.0 110.203 179.361 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -175.35 -172.21 40.03 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.915 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.417 ' CA ' HG12 ' B' ' 4' ' ' ILE . 97.7 m-85 -147.98 155.12 41.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.109 -1.23 . . . . 0.0 110.524 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' A' ' 79' ' ' MET . 27.4 mtt -123.98 173.75 8.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.405 -0.809 . . . . 0.0 110.052 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.487 ' C ' ' CG1' ' B' ' 81' ' ' ILE . 0.0 OUTLIER -138.23 109.14 6.71 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.19 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.487 ' CG1' ' C ' ' B' ' 80' ' ' SER . 10.4 mt . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.108 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' A' ' 2' ' ' THR . 70.1 mtm . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.213 0.53 . . . . 0.0 110.176 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' A' ' 1' ' ' MET . 76.7 m -43.71 105.23 0.42 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.498 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 46.5 Cg_endo -56.42 157.65 17.77 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 O-C-N 124.15 1.605 . . . . 0.0 110.743 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.5 pp -144.09 168.28 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.37 -0.832 . . . . 0.0 109.947 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.435 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 8.8 p -146.11 129.82 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.949 . . . . 0.0 110.544 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.547 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 2.7 m170 -106.35 122.94 47.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.203 -0.936 . . . . 0.0 110.072 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.8 mt -114.36 146.87 40.01 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.179 -0.951 . . . . 0.0 110.127 179.919 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.508 ' HB2' HG12 ' A' ' 48' ' ' ILE . 31.9 ttpt -141.43 165.58 27.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.186 -0.946 . . . . 0.0 110.721 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.42 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 154.28 -168.11 32.5 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.445 ' O ' ' HB ' ' A' ' 13' ' ' THR . 9.3 m-20 -64.71 142.27 58.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.183 -1.187 . . . . 0.0 109.921 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.428 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -49.89 -68.5 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.222 -0.924 . . . . 0.0 110.282 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -44.27 -43.56 7.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.3 -0.875 . . . . 0.0 110.245 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.445 ' HB ' ' O ' ' A' ' 10' ' ' ASP . 7.0 m -58.11 -28.52 64.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.161 -0.962 . . . . 0.0 110.309 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.428 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 17.6 mt -77.17 -29.8 54.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.272 -0.892 . . . . 0.0 110.164 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.41 ' HB2' ' HE3' ' A' ' 15' ' ' LYS . 13.5 ttmt -60.01 -34.59 73.56 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.288 -0.882 . . . . 0.0 110.054 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.475 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 12.3 t -70.13 -37.08 75.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.355 -0.841 . . . . 0.0 110.664 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 20.7 mt -58.98 -48.17 82.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.137 -0.977 . . . . 0.0 110.45 -179.724 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.3 ttp180 -47.33 -33.46 5.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.397 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.541 ' C ' ' CD1' ' A' ' 19' ' ' TYR . 4.2 t80 -64.59 -38.44 91.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.29 -0.882 . . . . 0.0 110.305 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -69.46 -33.16 72.51 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.18 -0.95 . . . . 0.0 110.213 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.536 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.48 -31.74 72.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.191 -0.943 . . . . 0.0 110.276 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.46 -16.54 60.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.227 -0.921 . . . . 0.0 110.148 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -75.02 -41.0 60.18 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.651 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.576 ' CB ' ' HB2' ' A' ' 27' ' ' LEU . 5.0 m-70 -95.08 75.97 3.49 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.305 -0.872 . . . . 0.0 109.559 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 p -58.18 -6.45 0.63 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.484 -0.76 . . . . 0.0 111.933 -179.233 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.82 31.98 1.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.584 -1.322 . . . . 0.0 111.1 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.576 ' HB2' ' CB ' ' A' ' 24' ' ' HIS . 2.1 mt -93.1 -35.46 13.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.437 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -107.94 169.68 8.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.17 -0.957 . . . . 0.0 110.318 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.517 ' OG1' ' N ' ' A' ' 54' ' ' ASP . 36.3 m -100.2 -34.36 10.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.286 -0.884 . . . . 0.0 111.131 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.447 ' HB3' ' CZ3' ' B' ' 37' ' ' TRP . . . -159.75 117.72 2.7 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.977 -1.077 . . . . 0.0 110.72 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.441 HG11 ' O ' ' A' ' 31' ' ' VAL . 4.9 p -90.69 105.64 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.127 -0.983 . . . . 0.0 109.9 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.45 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 1.4 p -68.58 155.06 40.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.142 -0.974 . . . . 0.0 110.404 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.6 p -61.37 163.83 6.22 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 109.992 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -67.99 125.58 26.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.222 -0.924 . . . . 0.0 110.471 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.527 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 25.9 p-90 -146.11 173.34 12.28 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.079 -1.013 . . . . 0.0 109.738 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.527 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 11.0 p80 -162.61 -175.38 4.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.084 -1.01 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.459 ' CZ3' ' HB3' ' B' ' 30' ' ' ALA . 68.3 m95 -79.31 155.03 28.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.278 -0.889 . . . . 0.0 110.105 179.836 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -142.99 -165.14 2.0 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 127.13 -120.79 3.69 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -47.04 -24.13 0.59 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -1.139 . . . . 0.0 110.399 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.405 ' OD1' ' HG3' ' A' ' 45' ' ' LYS . 10.9 t-20 -135.68 76.25 1.6 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.265 -0.897 . . . . 0.0 110.38 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.45 HG21 ' N ' ' A' ' 43' ' ' LYS . 35.4 m -53.99 -23.58 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.169 -0.957 . . . . 0.0 109.864 179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.45 ' N ' HG21 ' A' ' 42' ' ' VAL . 7.4 mttp -59.29 167.98 1.63 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -0.858 . . . . 0.0 109.943 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -45.89 112.35 0.46 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.24 -0.913 . . . . 0.0 109.996 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.405 ' HG3' ' OD1' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -111.49 -57.86 2.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.22 -179.882 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.498 ' O ' HG13 ' A' ' 48' ' ' ILE . 3.5 m -145.17 67.96 1.23 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.22 -0.925 . . . . 0.0 110.407 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.459 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . -45.01 129.2 7.44 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.171 -0.956 . . . . 0.0 109.78 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.508 HG12 ' HB2' ' A' ' 8' ' ' LYS . 43.6 mt -142.69 141.9 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.118 -0.989 . . . . 0.0 110.601 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.4 ' N ' HG21 ' A' ' 48' ' ' ILE . 4.4 t -111.63 117.32 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.414 -0.804 . . . . 0.0 109.958 179.706 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.476 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 50.3 m -93.69 146.58 23.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 110.008 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.495 ' N ' HD12 ' A' ' 51' ' ' LEU . 5.4 mp -135.62 129.73 33.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.128 -0.983 . . . . 0.0 110.273 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -97.95 136.4 38.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.548 -0.72 . . . . 0.0 110.114 179.72 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.498 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 89.9 m-85 -110.42 150.6 28.59 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.85 . . . . 0.0 109.865 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.517 ' N ' ' OG1' ' A' ' 29' ' ' THR . 1.8 t0 -84.52 -10.06 57.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.976 . . . . 0.0 110.458 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.492 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 0.4 OUTLIER -149.06 150.83 33.43 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.118 -0.989 . . . . 0.0 110.314 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.96 -56.21 9.86 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.523 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 12.3 p90 -53.95 -36.81 63.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.195 -0.941 . . . . 0.0 110.003 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.523 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 64.7 tt0 -58.32 -49.22 77.97 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.262 -0.899 . . . . 0.0 110.22 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -58.71 -36.27 73.99 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.264 -0.897 . . . . 0.0 110.112 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.487 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 18.8 m-20 -61.42 -42.24 98.43 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.28 -0.888 . . . . 0.0 110.528 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.497 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 62.1 mt-30 -65.92 -37.32 85.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.06 -1.025 . . . . 0.0 110.308 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.547 ' CD1' ' N ' ' A' ' 63' ' ' LEU . 10.5 t80 -55.41 -63.75 1.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.204 -0.935 . . . . 0.0 110.276 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.547 ' N ' ' CD1' ' A' ' 62' ' ' PHE . 3.2 pp -59.79 -17.1 33.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.251 -0.906 . . . . 0.0 110.585 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.442 ' HB3' ' O ' ' A' ' 60' ' ' ASP . 0.9 OUTLIER -83.87 -20.81 32.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.948 . . . . 0.0 110.434 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.497 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 41.5 mt-30 -95.53 -61.92 1.38 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.166 -0.959 . . . . 0.0 110.17 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 15.7 m -79.63 70.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.156 -0.965 . . . . 0.0 109.876 179.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -44.85 117.98 1.49 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.551 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.469 HG12 ' HB ' ' A' ' 72' ' ' ILE . 0.9 OUTLIER -88.61 134.31 34.34 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 110.141 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.424 ' HG2' HD13 ' A' ' 72' ' ' ILE . 47.0 Cg_endo -55.25 176.52 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 123.875 1.46 . . . . 0.0 110.66 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.3 tptt -81.94 3.24 27.14 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.29 -33.19 24.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 109.795 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.469 ' HB ' HG12 ' A' ' 68' ' ' ILE . 2.0 mp -93.92 123.21 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.412 -0.805 . . . . 0.0 109.903 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.6 m -94.61 138.17 32.81 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 7.7 p -90.86 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 0.0 111.171 -178.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.547 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -143.69 157.57 44.3 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.736 -0.603 . . . . 0.0 110.058 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.9 p -133.13 133.12 42.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.187 -0.946 . . . . 0.0 110.172 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.7 -165.69 15.76 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' B' ' 78' ' ' PHE . 55.9 m-85 -147.88 153.63 39.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.185 -1.185 . . . . 0.0 110.356 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 93.5 mmm -139.26 152.78 47.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.219 -0.926 . . . . 0.0 110.2 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.5 t -134.96 100.57 4.62 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.229 -0.919 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 24.9 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.254 179.796 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' B' ' 2' ' ' THR . 69.6 mtm . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.236 0.541 . . . . 0.0 110.106 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' B' ' 1' ' ' MET . 54.7 m -43.79 104.25 0.37 Allowed Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.324 -0.86 . . . . 0.0 110.169 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.505 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.1 Cg_endo -55.38 157.73 14.04 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.14 1.6 . . . . 0.0 110.746 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 2.6 pp -144.23 168.55 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.297 -0.877 . . . . 0.0 110.068 179.813 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.434 ' O ' ' CG1' ' B' ' 5' ' ' VAL . 9.4 p -146.45 129.76 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.154 -0.966 . . . . 0.0 110.552 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.554 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 2.9 m170 -106.52 123.34 47.95 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.268 -0.895 . . . . 0.0 110.152 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 12.1 mt -114.47 146.61 40.45 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.112 -0.992 . . . . 0.0 110.163 -179.965 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.506 ' HB2' HG12 ' B' ' 48' ' ' ILE . 31.7 ttpt -141.48 165.42 27.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.08 -1.013 . . . . 0.0 110.723 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.425 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 154.44 -167.96 32.56 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . 0.429 ' O ' ' HB ' ' B' ' 13' ' ' THR . 8.8 m-20 -64.77 142.84 58.29 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.272 -1.134 . . . . 0.0 109.99 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.457 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -49.89 -68.72 0.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.231 -0.918 . . . . 0.0 110.529 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -44.43 -43.61 7.86 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 110.358 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.429 ' HB ' ' O ' ' B' ' 10' ' ' ASP . 6.3 m -57.83 -28.74 64.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.164 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.457 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 19.9 mt -76.53 -30.31 57.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' B' ' 15' ' ' LYS . 12.5 ttmt -59.96 -35.11 74.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -0.855 . . . . 0.0 110.156 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.481 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 12.0 t -69.87 -36.75 75.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.202 -0.937 . . . . 0.0 110.425 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 19.0 mt -58.81 -48.62 80.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.092 -1.005 . . . . 0.0 110.541 -179.828 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 19.0 ttp180 -47.5 -32.78 5.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.17 -0.956 . . . . 0.0 110.349 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.536 ' C ' ' CD1' ' B' ' 19' ' ' TYR . 4.6 t80 -64.76 -38.12 89.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.178 -0.951 . . . . 0.0 110.329 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -69.91 -33.4 72.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.201 -0.937 . . . . 0.0 110.264 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.54 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.34 -31.42 72.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.263 -0.898 . . . . 0.0 110.375 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.39 -16.83 61.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.204 -0.935 . . . . 0.0 110.254 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -74.89 -41.17 60.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.193 -0.942 . . . . 0.0 109.75 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.575 ' CB ' ' HB2' ' B' ' 27' ' ' LEU . 5.1 m-70 -94.89 76.11 3.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.263 -0.898 . . . . 0.0 109.368 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.03 -6.84 0.65 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.441 -0.787 . . . . 0.0 112.088 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.67 31.88 1.65 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.589 -1.319 . . . . 0.0 111.099 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.575 ' HB2' ' CB ' ' B' ' 24' ' ' HIS . 2.0 mt -93.02 -34.95 13.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.057 -1.027 . . . . 0.0 110.355 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -108.04 169.96 8.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.524 ' OG1' ' N ' ' B' ' 54' ' ' ASP . 40.1 m -100.32 -34.82 9.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.28 -0.888 . . . . 0.0 111.077 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.459 ' HB3' ' CZ3' ' A' ' 37' ' ' TRP . . . -159.83 118.21 2.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.965 -1.085 . . . . 0.0 110.643 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.438 HG11 ' O ' ' B' ' 31' ' ' VAL . 5.4 p -90.82 105.17 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.116 -0.99 . . . . 0.0 110.055 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.471 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 1.7 p -68.22 154.76 41.08 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.146 -0.972 . . . . 0.0 110.292 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 12.9 p -61.36 164.64 5.36 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.173 -0.954 . . . . 0.0 110.153 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.13 124.93 24.79 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.292 -0.88 . . . . 0.0 110.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.54 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 25.1 p-90 -145.57 173.5 11.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.026 -1.046 . . . . 0.0 109.789 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.54 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 10.4 p80 -162.69 -175.06 4.24 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.614 -179.601 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.447 ' CZ3' ' HB3' ' A' ' 30' ' ' ALA . 67.1 m95 -79.8 155.66 27.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.333 -0.854 . . . . 0.0 110.063 179.921 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -143.64 -164.28 1.84 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.13 -0.981 . . . . 0.0 110.23 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 126.22 -117.8 2.94 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -50.22 -24.77 3.06 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.303 -1.116 . . . . 0.0 110.316 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . 0.416 ' OD1' ' HG3' ' B' ' 45' ' ' LYS . 11.5 t-20 -134.6 74.87 1.55 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.169 -0.957 . . . . 0.0 110.357 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.449 HG21 ' N ' ' B' ' 43' ' ' LYS . 35.3 m -52.27 -23.7 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.265 -0.897 . . . . 0.0 110.011 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.449 ' N ' HG21 ' B' ' 42' ' ' VAL . 7.4 mttp -59.78 166.86 2.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.286 -0.884 . . . . 0.0 110.152 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . 0.417 ' C ' ' O ' ' B' ' 43' ' ' LYS . 0.8 OUTLIER -44.31 111.96 0.36 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.176 -0.953 . . . . 0.0 109.905 179.807 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . 0.416 ' HG3' ' OD1' ' B' ' 41' ' ' ASN . 0.0 OUTLIER -111.65 -56.96 2.32 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.192 -0.942 . . . . 0.0 110.425 -179.802 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.491 ' O ' ' HB3' ' B' ' 36' ' ' HIS . 3.5 m -145.92 67.71 1.2 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.197 -0.939 . . . . 0.0 110.194 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.475 ' HA ' ' HB3' ' B' ' 36' ' ' HIS . . . -45.06 129.24 7.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.268 -0.895 . . . . 0.0 109.891 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.506 HG12 ' HB2' ' B' ' 8' ' ' LYS . 45.1 mt -142.66 142.34 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.169 -0.957 . . . . 0.0 110.645 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . 0.41 ' N ' HG21 ' B' ' 48' ' ' ILE . 4.4 t -112.01 117.06 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.443 -0.786 . . . . 0.0 109.716 179.523 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.448 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 54.5 m -93.15 147.4 22.91 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.251 -0.906 . . . . 0.0 109.916 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.466 HD12 ' N ' ' B' ' 51' ' ' LEU . 5.3 mp -136.28 129.77 31.98 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 110.317 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -98.14 136.24 38.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 179.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.505 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 89.1 m-85 -110.56 150.74 28.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.294 -0.879 . . . . 0.0 109.839 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.524 ' N ' ' OG1' ' B' ' 29' ' ' THR . 1.4 t0 -84.7 -10.16 57.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.133 -0.979 . . . . 0.0 110.516 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' SER . . . . . 0.517 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 0.4 OUTLIER -148.49 151.51 35.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.153 -0.967 . . . . 0.0 110.243 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.31 -56.03 10.0 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.279 -0.888 . . . . 0.0 109.978 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . 0.53 ' CD1' ' N ' ' B' ' 58' ' ' GLN . 12.3 p90 -54.21 -37.15 64.25 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 0.0 110.228 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.53 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 63.8 tt0 -58.37 -48.32 80.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -0.929 . . . . 0.0 110.206 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -59.14 -36.59 75.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.149 -0.969 . . . . 0.0 110.154 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.489 ' O ' ' HG ' ' B' ' 63' ' ' LEU . 19.3 m-20 -61.31 -41.91 97.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 110.437 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.485 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 61.6 mt-30 -65.91 -37.32 85.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 0.0 110.145 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.546 ' CD1' ' N ' ' B' ' 63' ' ' LEU . 10.5 t80 -55.64 -63.57 1.13 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.116 -0.99 . . . . 0.0 110.262 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.546 ' N ' ' CD1' ' B' ' 62' ' ' PHE . 3.3 pp -59.93 -16.65 31.48 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.272 -0.892 . . . . 0.0 110.516 -179.487 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.447 ' HB3' ' O ' ' B' ' 60' ' ' ASP . 1.0 OUTLIER -84.5 -21.09 30.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.244 -0.91 . . . . 0.0 110.376 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . 0.485 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 39.3 mt-30 -95.22 -62.85 1.23 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.982 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 16.3 m -78.57 70.88 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.049 -1.032 . . . . 0.0 109.816 179.582 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -45.75 118.37 1.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.289 -0.882 . . . . 0.0 110.472 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.451 HG12 ' HB ' ' B' ' 72' ' ' ILE . 0.9 OUTLIER -88.71 134.91 32.94 Favored Pre-proline 0 N--CA 1.486 1.35 0 O-C-N 121.232 -0.917 . . . . 0.0 110.331 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.459 ' HG2' HD13 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -55.88 176.8 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.048 1.552 . . . . 0.0 110.663 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -82.61 3.23 29.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.351 -0.843 . . . . 0.0 110.356 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -32.79 24.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.131 -0.981 . . . . 0.0 109.696 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.459 HD13 ' HG2' ' B' ' 69' ' ' PRO . 2.0 mp -94.48 123.61 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.552 -0.717 . . . . 0.0 109.985 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.5 m -95.06 138.42 32.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.155 -0.965 . . . . 0.0 109.982 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 7.4 p -90.78 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.151 -0.968 . . . . 0.0 110.995 -178.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' SER . . . . . 0.554 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.62 157.65 44.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.763 -0.585 . . . . 0.0 110.173 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.2 p -133.49 133.57 42.39 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.0 110.281 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.87 -165.15 14.89 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 78' ' ' PHE . 55.7 m-85 -148.15 153.12 38.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.176 -1.19 . . . . 0.0 110.207 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 95.1 mmm -138.59 152.68 48.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t -135.09 100.58 4.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 110.338 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.173 179.945 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.7 mtp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.183 0.516 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.29 132.84 43.93 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.002 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.499 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 43.1 Cg_endo -91.2 166.19 3.65 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.78 1.411 . . . . 0.0 110.668 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.459 HG22 ' HA ' ' A' ' 52' ' ' THR . 1.4 pt -144.05 179.62 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.408 -0.808 . . . . 0.0 110.154 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.528 HG11 ' CG2' ' A' ' 74' ' ' VAL . 1.0 OUTLIER -146.33 129.88 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.245 -0.909 . . . . 0.0 110.193 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.491 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.38 121.48 43.99 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.308 -0.87 . . . . 0.0 110.088 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.536 ' O ' ' CG2' ' A' ' 48' ' ' ILE . 4.2 tp -119.74 139.92 51.53 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.192 -0.943 . . . . 0.0 110.148 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.5 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.6 ttpp -142.39 167.13 22.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 0.0 110.573 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.5 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 154.74 -166.49 32.39 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.474 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 65.4 m-20 -64.65 136.73 57.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -1.233 . . . . 0.0 109.968 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.464 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.78 -46.57 59.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 111.169 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -63.51 -46.8 84.38 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.118 -0.989 . . . . 0.0 111.196 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.474 ' OG1' ' HB2' ' A' ' 10' ' ' ASP . 6.4 m -57.72 -31.19 66.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.901 -1.125 . . . . 0.0 110.383 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 11' ' ' ALA . 6.7 mt -75.06 -25.44 58.63 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -59.46 -40.63 87.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.545 -0.722 . . . . 0.0 110.294 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.466 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 22.4 t -70.12 -36.89 75.14 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.222 -0.924 . . . . 0.0 110.527 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.48 HD11 ' CD1' ' A' ' 68' ' ' ILE . 17.5 mt -58.85 -54.79 43.09 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.085 -179.899 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.484 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 26.9 ttt180 -47.28 -26.29 1.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.54 -0.725 . . . . 0.0 110.762 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.473 ' C ' ' CD1' ' A' ' 19' ' ' TYR . 10.9 t80 -64.92 -50.9 64.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 0.0 110.747 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.48 -13.54 62.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.474 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.484 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 2.4 m-30 -66.33 -35.4 80.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.203 -0.936 . . . . 0.0 110.076 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.534 ' HE2' ' NE2' ' B' ' 40' ' ' HIS . 26.3 mmmt -63.52 -29.83 71.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.32 -0.862 . . . . 0.0 110.261 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -74.91 -41.09 60.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.21 -0.931 . . . . 0.0 109.762 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.45 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 68.2 m-70 -95.14 37.27 1.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.32 -0.863 . . . . 0.0 109.94 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.58 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 8.7 p -57.22 -14.35 4.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.311 -0.868 . . . . 0.0 110.428 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 p -96.72 6.67 48.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.103 -0.998 . . . . 0.0 110.182 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.456 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 6.6 mp -92.39 -35.04 13.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 110.376 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.58 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 39.3 p90 -111.05 165.77 11.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.189 -0.944 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.06 -30.47 12.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.233 -0.917 . . . . 0.0 110.737 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.576 ' HB3' ' CE3' ' B' ' 37' ' ' TRP . . . -159.66 114.48 2.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.226 -0.921 . . . . 0.0 110.557 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.542 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 11.7 p -89.98 99.69 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.119 -0.988 . . . . 0.0 110.135 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.483 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -50.74 147.9 4.44 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.217 -0.927 . . . . 0.0 110.179 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t -60.82 164.47 4.75 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.085 -1.01 . . . . 0.0 109.829 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.7 121.21 15.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.173 -0.954 . . . . 0.0 110.255 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.522 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 55.7 p-90 -145.03 -177.56 5.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 109.605 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.501 ' CD2' ' C ' ' A' ' 35' ' ' TRP . 0.8 OUTLIER -162.68 170.73 17.97 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.027 -1.045 . . . . 0.0 110.422 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.513 ' CE3' ' HB3' ' B' ' 30' ' ' ALA . 26.3 m95 -79.37 105.23 10.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.337 -0.852 . . . . 0.0 110.033 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 9.0 t -171.26 175.0 4.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.272 -0.893 . . . . 0.0 110.315 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -121.58 -76.06 0.4 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.408 ' NE2' ' HE2' ' B' ' 22' ' ' LYS . 7.6 m-70 -98.99 -87.38 0.35 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.206 -1.173 . . . . 0.0 109.943 179.775 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -116.85 153.34 32.69 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.327 -0.858 . . . . 0.0 109.985 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -141.57 127.72 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.1 -1.0 . . . . 0.0 110.171 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -85.52 -17.42 36.45 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.301 -0.874 . . . . 0.0 110.19 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -79.44 -139.4 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 0.0 110.085 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.8 mmmt -108.37 152.98 23.92 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.229 -0.919 . . . . 0.0 110.154 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.423 ' C ' ' HB3' ' A' ' 36' ' ' HIS . 0.1 OUTLIER -162.38 82.37 0.54 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.873 . . . . 0.0 110.032 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -157.1 102.46 1.97 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 110.268 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.536 ' CG2' ' O ' ' A' ' 7' ' ' LEU . 19.1 mt -141.96 148.81 20.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.336 -0.852 . . . . 0.0 109.678 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.442 ' N ' HG22 ' A' ' 48' ' ' ILE . 97.2 t -126.69 113.12 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.104 -0.998 . . . . 0.0 110.654 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.414 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 94.6 m -93.86 156.88 16.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 109.809 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 50' ' ' THR . 1.6 mp -137.36 139.86 41.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.565 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.478 HG22 ' CZ2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.54 125.08 40.77 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.653 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.499 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 28.3 m-85 -107.79 148.71 29.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.445 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.51 -16.78 28.24 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 85.0 p -147.61 148.15 30.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.148 -0.97 . . . . 0.0 110.178 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.433 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 16.0 mt-10 -70.16 -36.97 75.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.209 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 43.2 t-105 -53.78 -48.0 70.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.296 -0.877 . . . . 0.0 109.988 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 55.2 tt0 -57.07 -36.05 70.09 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.312 -0.867 . . . . 0.0 110.53 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.433 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 1.1 ttp180 -59.62 -44.93 93.29 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.208 -0.933 . . . . 0.0 110.948 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -61.3 -40.58 94.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.111 -0.993 . . . . 0.0 111.391 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.419 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 56.7 mt-30 -65.42 -43.33 90.85 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.886 -1.134 . . . . 0.0 110.743 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.55 ' CE1' HG23 ' A' ' 66' ' ' VAL . 15.9 t80 -55.96 -51.72 66.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.23 -0.919 . . . . 0.0 110.789 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 43.1 mt -59.61 -14.74 14.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.199 -0.938 . . . . 0.0 110.605 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.8 t -96.44 -21.91 17.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.897 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.419 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 4.8 mt-30 -95.85 -34.19 11.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.071 -1.018 . . . . 0.0 110.438 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.55 HG23 ' CE1' ' A' ' 62' ' ' PHE . 19.5 m -87.03 109.12 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.101 -0.999 . . . . 0.0 110.624 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.3 137.33 36.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.553 HD13 ' CG2' ' A' ' 72' ' ' ILE . 18.2 tt -150.37 131.57 7.41 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.011 -1.055 . . . . 0.0 110.739 -179.202 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.542 ' HD2' ' CG1' ' A' ' 68' ' ' ILE . 43.6 Cg_endo -47.28 -178.39 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 124.246 1.656 . . . . 0.0 111.063 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.54 6.06 45.17 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.235 -0.915 . . . . 0.0 110.377 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.521 ' CG2' HG12 ' A' ' 72' ' ' ILE . 9.8 t -84.21 -30.38 25.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.063 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.553 ' CG2' HD13 ' A' ' 68' ' ' ILE . 17.3 mm -94.86 103.23 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.4 m -95.35 157.78 15.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.243 -0.911 . . . . 0.0 109.997 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.528 ' CG2' HG11 ' A' ' 5' ' ' VAL . 9.8 p -145.85 157.88 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.147 -0.971 . . . . 0.0 110.592 -179.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.59 -179.13 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.452 -0.78 . . . . 0.0 110.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 p -107.4 170.46 7.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.109 -0.994 . . . . 0.0 110.79 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.443 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -164.4 -174.07 33.76 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' B' ' 78' ' ' PHE . 38.6 m-85 -148.1 142.08 25.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.223 -1.163 . . . . 0.0 110.69 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 90.3 mmm -122.94 156.91 33.75 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 110.042 179.846 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -135.62 102.74 5.2 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.349 -0.844 . . . . 0.0 110.146 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.406 HG22 HD11 ' A' ' 81' ' ' ILE . 14.4 pt . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.289 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.185 0.517 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.54 132.99 42.96 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 109.964 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.507 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 44.2 Cg_endo -91.8 165.9 3.29 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.923 1.486 . . . . 0.0 110.678 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.48 HG22 ' HA ' ' B' ' 52' ' ' THR . 1.4 pt -144.18 -179.92 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.354 -0.841 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.534 HG11 ' CG2' ' B' ' 74' ' ' VAL . 1.0 OUTLIER -146.59 130.94 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.119 -0.988 . . . . 0.0 110.213 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.496 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.1 OUTLIER -106.06 121.69 44.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.124 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.527 ' O ' ' CG2' ' B' ' 48' ' ' ILE . 4.2 tp -119.79 139.94 51.54 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.216 -0.928 . . . . 0.0 110.1 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.494 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 9.9 ttpp -142.55 167.36 22.27 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.11 -0.994 . . . . 0.0 110.534 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.494 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 154.74 -166.34 32.34 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . 0.485 ' HB2' ' OG1' ' B' ' 13' ' ' THR . 67.2 m-20 -64.99 136.42 56.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.129 -1.218 . . . . 0.0 109.752 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.473 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.57 -45.53 57.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 111.297 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -64.38 -46.3 83.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.121 -0.987 . . . . 0.0 111.117 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.485 ' OG1' ' HB2' ' B' ' 10' ' ' ASP . 6.5 m -57.87 -31.57 66.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.026 -1.046 . . . . 0.0 110.345 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.473 HD12 ' HA ' ' B' ' 11' ' ' ALA . 6.2 mt -74.93 -25.13 58.68 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.211 -0.931 . . . . 0.0 109.548 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.58 -40.31 86.98 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.438 -0.789 . . . . 0.0 110.069 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.468 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.0 t -70.21 -37.25 75.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.308 -0.87 . . . . 0.0 110.473 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.52 HD11 ' CD1' ' B' ' 68' ' ' ILE . 17.1 mt -58.81 -54.62 45.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.19 -0.944 . . . . 0.0 110.17 -179.872 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.489 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 27.6 ttt180 -47.19 -26.19 1.1 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.494 -0.754 . . . . 0.0 110.77 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.477 ' C ' ' CD1' ' B' ' 19' ' ' TYR . 11.1 t80 -65.03 -50.79 64.86 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.038 -1.039 . . . . 0.0 110.79 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.66 -13.39 62.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.168 -0.958 . . . . 0.0 110.539 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.489 ' HB2' ' O ' ' B' ' 18' ' ' ARG . 2.4 m-30 -66.48 -35.62 80.73 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.15 -0.969 . . . . 0.0 110.262 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . 0.408 ' HE2' ' NE2' ' A' ' 40' ' ' HIS . 26.2 mmmt -63.33 -29.87 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.188 -0.945 . . . . 0.0 110.37 -179.921 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -74.85 -41.26 60.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.108 -0.995 . . . . 0.0 109.831 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.467 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 66.7 m-70 -95.09 37.05 1.17 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.34 -0.85 . . . . 0.0 109.861 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.586 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 7.7 p -57.07 -14.44 3.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.376 -0.827 . . . . 0.0 110.457 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 27.5 p -96.35 6.77 48.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.168 -0.957 . . . . 0.0 110.103 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.491 ' O ' ' NE2' ' B' ' 58' ' ' GLN . 6.5 mp -92.54 -35.5 13.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.315 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.586 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 37.5 p90 -110.54 166.21 11.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.147 -0.971 . . . . 0.0 110.197 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.7 -30.24 12.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.296 -0.878 . . . . 0.0 110.766 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.513 ' HB3' ' CE3' ' A' ' 37' ' ' TRP . . . -159.56 114.15 2.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.13 -0.981 . . . . 0.0 110.49 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.54 ' CG1' ' O ' ' B' ' 31' ' ' VAL . 12.1 p -90.02 99.36 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.097 -1.002 . . . . 0.0 109.725 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.522 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -50.87 148.28 4.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.117 -0.99 . . . . 0.0 110.102 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' SER . . . . . 0.412 ' HB3' ' HB2' ' A' ' 35' ' ' TRP . 3.9 t -60.98 164.62 4.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.894 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.6 m -67.69 121.71 16.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.237 -0.914 . . . . 0.0 110.319 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.5 ' C ' ' CD2' ' B' ' 36' ' ' HIS . 56.6 p-90 -145.34 -177.13 5.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.149 -0.969 . . . . 0.0 109.741 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.5 ' CD2' ' C ' ' B' ' 35' ' ' TRP . 0.7 OUTLIER -162.67 170.45 18.43 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.033 -1.042 . . . . 0.0 110.41 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.576 ' CE3' ' HB3' ' A' ' 30' ' ' ALA . 26.4 m95 -79.26 104.93 10.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' THR . . . . . 0.487 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 8.8 t -171.21 174.71 4.5 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.297 -0.877 . . . . 0.0 110.185 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -121.6 -76.41 0.41 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.456 -1.457 . . . . 0.0 109.456 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . 0.534 ' NE2' ' HE2' ' A' ' 22' ' ' LYS . 6.8 m-70 -98.11 -87.63 0.33 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.248 -1.148 . . . . 0.0 110.153 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -117.18 152.74 34.15 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.325 -0.86 . . . . 0.0 110.05 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.78 127.65 21.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.212 -0.93 . . . . 0.0 110.373 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -85.32 -18.18 34.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.334 -0.853 . . . . 0.0 109.986 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -78.45 -139.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.877 . . . . 0.0 110.079 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 15.4 mmmt -108.6 151.44 26.12 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.172 -0.955 . . . . 0.0 110.085 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.428 ' C ' ' HB3' ' B' ' 36' ' ' HIS . 0.1 OUTLIER -160.88 82.12 0.65 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.195 -0.941 . . . . 0.0 110.135 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -156.64 102.15 2.03 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.241 -0.912 . . . . 0.0 110.416 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.527 ' CG2' ' O ' ' B' ' 7' ' ' LEU . 19.7 mt -141.64 149.16 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 109.704 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . 0.46 ' N ' HG22 ' B' ' 48' ' ' ILE . 93.1 t -126.91 113.28 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.112 -0.992 . . . . 0.0 110.626 -179.664 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.419 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 97.7 m -94.26 156.86 16.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 109.899 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.401 ' HG ' ' O ' ' B' ' 50' ' ' THR . 1.7 mp -137.22 139.84 41.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.045 -1.034 . . . . 0.0 110.623 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.48 ' HA ' HG22 ' B' ' 4' ' ' ILE . 0.0 OUTLIER -96.67 125.18 40.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.728 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.507 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 28.9 m-85 -107.99 149.08 28.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 0.0 110.528 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.84 -16.59 28.01 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.407 -0.808 . . . . 0.0 110.17 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 85.1 p -147.83 146.7 29.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.453 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 15.6 mt-10 -68.71 -37.64 79.65 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.152 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . 0.416 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 44.3 t-105 -53.7 -48.32 69.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.318 -0.864 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.491 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.5 tt0 -56.8 -35.72 69.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.408 -0.807 . . . . 0.0 110.453 -179.203 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.449 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 1.1 ttp180 -59.83 -45.44 92.39 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.042 -1.036 . . . . 0.0 110.979 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -60.95 -40.23 92.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.163 -0.96 . . . . 0.0 111.235 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.432 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 57.4 mt-30 -65.62 -43.44 89.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.051 -1.031 . . . . 0.0 110.73 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.536 ' CE1' HG23 ' B' ' 66' ' ' VAL . 17.1 t80 -55.88 -51.66 66.79 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.286 -0.884 . . . . 0.0 110.672 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.78 -15.51 20.98 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.134 -0.979 . . . . 0.0 110.765 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 10.6 t -95.49 -21.99 17.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.117 -0.989 . . . . 0.0 110.974 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . 0.432 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 4.6 mt-30 -95.91 -33.06 12.33 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.079 -1.013 . . . . 0.0 110.545 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.536 HG23 ' CE1' ' B' ' 62' ' ' PHE . 20.1 m -88.3 109.43 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.208 -0.932 . . . . 0.0 110.616 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.97 137.29 36.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.945 . . . . 0.0 109.507 179.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.549 ' CG1' ' HD2' ' B' ' 69' ' ' PRO . 18.4 tt -150.3 131.68 7.5 Favored Pre-proline 0 C--N 1.305 -1.369 0 O-C-N 120.993 -1.067 . . . . 0.0 110.518 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.549 ' HD2' ' CG1' ' B' ' 68' ' ' ILE . 42.2 Cg_endo -47.93 -179.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.711 0 O-C-N 124.148 1.604 . . . . 0.0 110.942 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -89.48 5.75 43.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.37 -0.831 . . . . 0.0 110.481 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' THR . . . . . 0.525 ' CG2' HG12 ' B' ' 72' ' ' ILE . 9.4 t -84.17 -30.58 25.71 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.158 -0.964 . . . . 0.0 110.227 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.532 ' CG2' HD13 ' B' ' 68' ' ' ILE . 16.8 mm -94.6 103.52 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -0.926 . . . . 0.0 110.254 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 63.2 m -95.41 157.39 15.92 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.237 -0.914 . . . . 0.0 110.204 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.534 ' CG2' HG11 ' B' ' 5' ' ' VAL . 9.8 p -145.64 157.49 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.059 -1.026 . . . . 0.0 110.743 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.3 -178.99 5.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.496 -0.753 . . . . 0.0 109.875 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.5 p -107.15 171.91 7.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.102 -0.999 . . . . 0.0 110.773 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . 0.462 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -164.98 -175.1 35.4 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' A' ' 78' ' ' PHE . 36.8 m-85 -147.8 140.57 24.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -1.133 . . . . 0.0 110.462 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 89.6 mmm -121.99 157.53 31.12 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 110.033 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -135.84 103.51 5.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.239 -0.913 . . . . 0.0 110.178 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.413 HG22 HD11 ' B' ' 81' ' ' ILE . 13.8 pt . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.18 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.252 0.549 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 m -72.33 123.62 89.74 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.286 -0.884 . . . . 0.0 110.256 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.7 Cg_endo -76.92 153.06 32.6 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 O-C-N 123.947 1.498 . . . . 0.0 110.296 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 3' ' ' PRO . 0.8 OUTLIER -144.2 176.4 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.427 HG21 ' HB2' ' A' ' 51' ' ' LEU . 2.4 m -146.33 129.05 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.313 -0.867 . . . . 0.0 110.214 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.494 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 1.1 m170 -104.98 116.51 32.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.936 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.531 HD23 ' CG2' ' A' ' 72' ' ' ILE . 1.0 OUTLIER -109.75 142.51 40.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.225 -0.922 . . . . 0.0 110.142 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.463 ' HB2' HG12 ' A' ' 48' ' ' ILE . 14.9 ttpt -141.5 166.48 24.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.261 -0.899 . . . . 0.0 110.492 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.25 -160.05 29.23 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.04 136.52 56.86 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -1.183 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.99 -29.59 8.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.301 -0.874 . . . . 0.0 110.52 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -78.01 -46.3 21.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.106 -0.996 . . . . 0.0 110.173 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.427 ' O ' HD13 ' A' ' 17' ' ' LEU . 92.7 m -58.1 -14.08 6.09 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.389 -0.82 . . . . 0.0 110.419 179.974 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.43 HD12 ' O ' ' A' ' 47' ' ' ALA . 16.0 mt -87.62 -38.39 15.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 110.423 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.03 -37.39 79.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.221 -0.924 . . . . 0.0 110.227 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.441 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 8.0 t -70.08 -37.29 75.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.317 -0.864 . . . . 0.0 110.558 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.427 HD13 ' O ' ' A' ' 13' ' ' THR . 19.1 mt -58.75 -48.84 79.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.079 -1.013 . . . . 0.0 110.223 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.561 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 19.5 ttm180 -47.69 -37.3 12.74 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.253 -0.905 . . . . 0.0 110.253 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 18.1 t80 -64.76 -31.25 72.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 0.0 110.627 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.419 ' NH1' ' HE3' ' A' ' 67' ' ' LYS . 6.2 mmt180 -70.42 -30.54 67.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.147 -0.971 . . . . 0.0 110.205 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.561 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.1 m-30 -66.63 -17.26 64.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.894 . . . . 0.0 110.327 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.8 mmtt -63.63 -33.0 74.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.305 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.509 ' O ' ' ND1' ' A' ' 24' ' ' HIS . 4.1 mmtp -75.03 -10.87 59.88 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.205 -0.934 . . . . 0.0 110.225 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.528 ' HB3' ' CD2' ' A' ' 27' ' ' LEU . 8.0 m-70 -144.7 46.32 1.37 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.215 -0.928 . . . . 0.0 109.928 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 11.3 t -57.43 -14.87 5.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.464 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -96.48 17.01 17.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.139 -0.976 . . . . 0.0 110.325 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.528 ' CD2' ' HB3' ' A' ' 24' ' ' HIS . 5.0 mp -92.41 -35.11 13.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.248 -0.908 . . . . 0.0 110.017 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.499 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 16.8 p90 -108.03 172.75 6.66 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.208 -0.933 . . . . 0.0 109.994 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 96.4 m -99.82 -32.05 11.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.198 -0.938 . . . . 0.0 111.372 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.75 119.89 3.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.859 -1.151 . . . . 0.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.423 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 9.4 p -89.1 114.9 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 109.655 179.213 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.614 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -83.79 152.78 24.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.149 -0.969 . . . . 0.0 110.671 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.4 p -61.36 164.79 5.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.322 -0.861 . . . . 0.0 110.425 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 m -68.12 126.17 28.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.355 -0.841 . . . . 0.0 110.239 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.592 ' CZ3' ' CB ' ' B' ' 32' ' ' SER . 1.6 p-90 -145.46 164.4 31.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.042 -1.036 . . . . 0.0 109.438 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.426 ' C ' ' CD2' ' A' ' 36' ' ' HIS . 2.0 p-80 -162.45 -178.72 6.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.967 -1.083 . . . . 0.0 110.973 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.553 ' CH2' HG23 ' B' ' 52' ' ' THR . 33.7 m95 -79.55 126.49 30.94 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.525 -0.734 . . . . 0.0 110.664 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.477 ' HB ' ' O ' ' A' ' 37' ' ' TRP . 0.6 OUTLIER 178.72 152.48 0.34 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.329 -0.857 . . . . 0.0 110.063 179.53 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -81.83 -41.9 9.35 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.518 ' O ' ' N ' ' A' ' 42' ' ' VAL . 12.1 t-80 -159.81 176.98 11.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -1.162 . . . . 0.0 110.104 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -54.64 86.2 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.128 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.518 ' N ' ' O ' ' A' ' 40' ' ' HIS . 12.7 m -122.11 -17.72 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.885 . . . . 0.0 110.122 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.404 ' HG2' ' O ' ' A' ' 42' ' ' VAL . 0.4 OUTLIER -147.47 132.7 18.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.302 -0.874 . . . . 0.0 110.13 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -101.1 4.33 42.08 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.19 -0.944 . . . . 0.0 110.375 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' A' ' 46' ' ' SER . 27.7 tttp -81.67 -60.07 2.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.242 -0.911 . . . . 0.0 110.201 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 45' ' ' LYS . 0.4 OUTLIER -43.36 149.64 0.24 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.134 -0.979 . . . . 0.0 110.143 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.43 ' O ' HD12 ' A' ' 14' ' ' LEU . . . -178.63 126.04 0.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 110.156 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.463 HG12 ' HB2' ' A' ' 8' ' ' LYS . 20.0 mt -142.49 147.31 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 0.0 110.248 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.442 ' N ' HG22 ' A' ' 48' ' ' ILE . 21.3 t -125.36 119.93 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.294 -0.879 . . . . 0.0 110.234 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.494 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 16.0 m -94.22 151.86 19.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.256 -0.902 . . . . 0.0 110.132 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.427 ' HB2' HG21 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -137.08 131.73 33.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 110.07 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.591 HG23 ' CH2' ' B' ' 37' ' ' TRP . 40.2 p -97.77 136.37 38.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -0.833 . . . . 0.0 110.239 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.561 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 37.5 m-85 -116.16 153.99 30.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.0 110.125 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -89.92 -13.88 35.37 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.25 -0.907 . . . . 0.0 110.768 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.572 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 1.7 m -142.28 151.13 41.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.044 -1.035 . . . . 0.0 110.221 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -70.97 -53.9 13.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.668 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 6.9 p90 -54.03 -35.16 61.64 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.098 -1.001 . . . . 0.0 110.063 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.668 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 33.3 tt0 -56.89 -37.76 71.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 110.024 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -59.59 -40.21 86.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 96.5 m-20 -61.08 -40.36 93.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.329 -0.857 . . . . 0.0 110.458 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.469 ' O ' ' OG ' ' A' ' 64' ' ' SER . 64.4 mt-30 -65.66 -40.68 92.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.224 -0.923 . . . . 0.0 110.36 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.407 ' HA ' HD23 ' A' ' 27' ' ' LEU . 85.9 t80 -55.7 -39.81 71.54 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.108 -0.995 . . . . 0.0 109.531 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 62.2 mt -58.89 -27.64 65.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.389 -0.819 . . . . 0.0 109.713 179.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 8.5 p -96.37 -6.21 38.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 109.794 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.466 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 20.0 mm-40 -95.23 -28.36 15.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.394 -0.817 . . . . 0.0 109.741 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.464 ' CG2' ' O ' ' A' ' 66' ' ' VAL . 33.3 m -131.26 85.47 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.324 -0.86 . . . . 0.0 109.863 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.427 ' C ' ' O ' ' A' ' 66' ' ' VAL . 7.4 pttp -41.85 135.82 2.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.237 -0.914 . . . . 0.0 110.423 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.475 HG21 ' HD2' ' A' ' 69' ' ' PRO . 1.4 mp -88.41 148.69 42.94 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.369 -0.832 . . . . 0.0 110.126 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.527 ' CG ' ' CG1' ' A' ' 72' ' ' ILE . 46.3 Cg_endo -70.81 -160.06 0.07 OUTLIER 'Trans proline' 0 C--N 1.302 -1.872 0 O-C-N 124.163 1.612 . . . . 0.0 110.579 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.42 ' O ' HG22 ' A' ' 71' ' ' THR . 0.3 OUTLIER -104.9 24.61 11.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.42 HG22 ' O ' ' A' ' 70' ' ' LYS . 1.9 p -154.42 3.15 0.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 111.441 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.531 ' CG2' HD23 ' A' ' 7' ' ' LEU . 9.6 mm -95.12 121.16 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.807 -1.183 . . . . 0.0 109.901 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 1.7 m -94.86 129.81 41.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 110.29 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.455 HG13 ' O ' ' A' ' 74' ' ' VAL . 2.9 p -112.02 100.37 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.476 -0.765 . . . . 0.0 109.822 178.513 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.02 175.99 5.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.746 -1.221 . . . . 0.0 110.536 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.9 p -109.06 153.26 23.9 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.025 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.16 178.36 38.0 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -147.84 139.14 23.58 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.269 -1.136 . . . . 0.0 110.263 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.417 ' SD ' ' CE1' ' B' ' 6' ' ' HIS . 2.1 mtm -126.01 138.21 53.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.108 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.26 101.82 6.91 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.23 -0.918 . . . . 0.0 110.336 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.19 179.879 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.244 0.545 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 3.0 m -71.96 123.76 89.91 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 110.279 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -76.97 153.21 32.47 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 123.997 1.525 . . . . 0.0 110.262 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.486 HG22 ' O ' ' B' ' 3' ' ' PRO . 0.7 OUTLIER -144.28 176.07 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.324 -0.86 . . . . 0.0 110.245 179.822 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.411 HG21 ' HB2' ' B' ' 51' ' ' LEU . 2.5 m -146.05 128.86 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.33 -0.856 . . . . 0.0 110.179 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.469 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.1 m170 -104.57 118.57 36.92 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.255 -0.903 . . . . 0.0 109.624 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.529 HD23 ' CG2' ' B' ' 72' ' ' ILE . 1.0 OUTLIER -111.69 142.37 44.11 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.426 -0.796 . . . . 0.0 110.139 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.456 ' HB2' HG12 ' B' ' 48' ' ' ILE . 15.0 ttpt -141.64 166.05 25.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.85 -160.14 29.48 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.98 136.17 56.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.279 -1.13 . . . . 0.0 110.158 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.83 -30.19 9.37 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.271 -0.893 . . . . 0.0 110.305 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -76.82 -46.76 23.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.254 -0.904 . . . . 0.0 110.223 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -57.96 -15.24 8.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.32 -0.862 . . . . 0.0 110.533 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.438 HD12 ' O ' ' B' ' 47' ' ' ALA . 16.6 mt -86.4 -38.07 17.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 110.561 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.1 -37.53 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.199 -0.938 . . . . 0.0 110.325 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.463 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 8.4 t -69.93 -37.22 75.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.919 . . . . 0.0 110.344 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 19.8 mt -58.69 -49.03 79.07 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.231 -179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.561 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 19.1 ttm180 -47.93 -36.62 12.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.409 -0.807 . . . . 0.0 110.151 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.463 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 21.9 t80 -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.427 -0.796 . . . . 0.0 110.503 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.424 ' NH1' ' HE3' ' B' ' 67' ' ' LYS . 6.3 mmt180 -69.83 -31.05 68.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.228 -0.92 . . . . 0.0 110.33 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.561 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.2 m-30 -66.4 -17.21 64.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.199 -0.938 . . . . 0.0 110.317 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -63.46 -32.83 74.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.26 -0.9 . . . . 0.0 110.191 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . 0.507 ' O ' ' ND1' ' B' ' 24' ' ' HIS . 4.0 mmtp -75.26 -10.67 59.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.208 -0.933 . . . . 0.0 110.214 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.534 ' HB3' ' CD2' ' B' ' 27' ' ' LEU . 8.6 m-70 -145.06 46.46 1.33 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.229 -0.919 . . . . 0.0 109.998 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.533 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 13.9 t -57.29 -14.54 4.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.258 -0.902 . . . . 0.0 110.565 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -96.59 16.26 19.35 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.251 -0.905 . . . . 0.0 110.294 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.534 ' CD2' ' HB3' ' B' ' 24' ' ' HIS . 5.2 mp -92.12 -34.08 14.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 110.025 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.533 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 17.1 p90 -108.37 172.54 6.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.9 . . . . 0.0 110.048 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -99.97 -32.11 11.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.157 -0.965 . . . . 0.0 111.283 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.86 119.88 2.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.899 -1.126 . . . . 0.0 111.013 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.427 ' O ' ' CG1' ' B' ' 31' ' ' VAL . 11.3 p -89.46 115.2 28.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.277 -0.889 . . . . 0.0 109.567 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.592 ' CB ' ' CZ3' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -83.92 153.34 24.01 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.204 -0.935 . . . . 0.0 110.74 -179.417 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 60.3 p -61.56 164.44 5.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.328 -0.858 . . . . 0.0 110.314 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -68.05 126.45 29.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.287 -0.883 . . . . 0.0 110.25 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.614 ' CZ3' ' CB ' ' A' ' 32' ' ' SER . 1.7 p-90 -145.71 164.93 30.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.014 -1.054 . . . . 0.0 109.567 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.417 ' CD2' ' C ' ' B' ' 36' ' ' HIS . 2.0 p-80 -162.46 -177.91 5.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.951 -1.093 . . . . 0.0 110.972 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.591 ' CH2' HG23 ' A' ' 52' ' ' THR . 34.1 m95 -79.87 127.0 31.72 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.415 -0.803 . . . . 0.0 110.507 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' THR . . . . . 0.49 ' HB ' ' O ' ' B' ' 37' ' ' TRP . 0.6 OUTLIER 178.12 151.88 0.27 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.271 -0.893 . . . . 0.0 110.167 179.492 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -81.13 -42.67 9.27 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . 0.517 ' O ' ' N ' ' B' ' 42' ' ' VAL . 11.4 t-80 -159.11 178.06 10.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.194 -1.18 . . . . 0.0 110.206 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -55.42 85.17 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.271 -0.893 . . . . 0.0 110.074 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.517 ' N ' ' O ' ' B' ' 40' ' ' HIS . 13.5 m -121.21 -17.66 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.174 -0.954 . . . . 0.0 110.367 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -147.4 132.74 18.52 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.25 -0.907 . . . . 0.0 109.968 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -100.91 3.63 41.93 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.255 -0.903 . . . . 0.0 110.373 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' B' ' 46' ' ' SER . 28.1 tttp -80.84 -61.14 2.05 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.209 -0.932 . . . . 0.0 110.146 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.423 ' C ' ' O ' ' B' ' 45' ' ' LYS . 0.3 OUTLIER -42.45 149.68 0.16 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.295 -0.878 . . . . 0.0 110.297 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.438 ' O ' HD12 ' B' ' 14' ' ' LEU . . . -178.91 126.1 0.1 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.279 -0.888 . . . . 0.0 110.191 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.456 HG12 ' HB2' ' B' ' 8' ' ' LYS . 20.1 mt -142.48 146.84 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.274 -0.891 . . . . 0.0 110.318 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . 0.428 ' N ' HG22 ' B' ' 48' ' ' ILE . 21.4 t -124.65 120.31 58.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.469 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 16.7 m -94.35 151.22 19.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.073 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.411 ' HB2' HG21 ' B' ' 5' ' ' VAL . 0.2 OUTLIER -136.83 131.76 33.7 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.927 . . . . 0.0 110.165 179.709 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.553 HG23 ' CH2' ' A' ' 37' ' ' TRP . 40.8 p -98.01 136.2 38.62 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.368 -0.833 . . . . 0.0 110.364 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.561 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 37.6 m-85 -116.18 154.13 30.6 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 110.147 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -90.07 -14.38 33.92 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.175 -0.953 . . . . 0.0 110.736 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' SER . . . . . 0.589 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 1.7 m -141.39 151.73 43.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.105 -0.997 . . . . 0.0 110.21 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -71.92 -53.55 12.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.23 -0.919 . . . . 0.0 110.37 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . 0.67 ' CD1' ' N ' ' B' ' 58' ' ' GLN . 6.3 p90 -53.92 -34.84 60.74 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.109 -0.995 . . . . 0.0 109.945 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.67 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 32.5 tt0 -57.0 -38.31 72.91 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.08 -1.012 . . . . 0.0 110.033 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -59.48 -39.71 84.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.226 -0.921 . . . . 0.0 109.927 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 96.6 m-20 -61.31 -39.97 92.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.317 -0.865 . . . . 0.0 110.216 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.467 ' O ' ' OG ' ' B' ' 64' ' ' SER . 65.3 mt-30 -65.85 -41.31 91.87 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.475 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 85.8 t80 -55.62 -39.5 70.89 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.196 -0.94 . . . . 0.0 109.53 179.657 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 67.1 mt -58.89 -27.25 65.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.472 -0.767 . . . . 0.0 109.827 179.505 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.467 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 6.5 p -96.95 -6.11 36.32 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.368 -0.832 . . . . 0.0 109.92 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . 0.461 ' OE1' HD21 ' B' ' 27' ' ' LEU . 19.5 mm-40 -95.13 -29.01 14.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.33 -0.856 . . . . 0.0 109.659 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.456 ' CG2' ' O ' ' B' ' 66' ' ' VAL . 33.1 m -130.55 86.69 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.443 -0.786 . . . . 0.0 109.79 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . 0.424 ' HE3' ' NH1' ' B' ' 20' ' ' ARG . 6.9 pttp -43.15 136.18 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.242 -0.911 . . . . 0.0 110.278 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.465 HG21 ' HD2' ' B' ' 69' ' ' PRO . 1.4 mp -88.49 148.61 42.58 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.24 -0.912 . . . . 0.0 109.992 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.525 ' CG ' ' CG1' ' B' ' 72' ' ' ILE . 45.0 Cg_endo -71.0 -160.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.1 1.579 . . . . 0.0 110.553 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.468 ' O ' HG22 ' B' ' 71' ' ' THR . 0.4 OUTLIER -104.43 24.77 11.1 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.136 -0.978 . . . . 0.0 110.44 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' THR . . . . . 0.468 HG22 ' O ' ' B' ' 70' ' ' LYS . 2.1 p -154.49 3.67 0.24 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.15 -0.969 . . . . 0.0 111.397 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.529 ' CG2' HD23 ' B' ' 7' ' ' LEU . 9.8 mm -95.48 121.49 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.774 -1.204 . . . . 0.0 109.917 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' THR . . . . . 0.469 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 1.6 m -95.28 129.61 42.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.202 -0.936 . . . . 0.0 110.394 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.439 ' O ' HG13 ' B' ' 74' ' ' VAL . 2.6 p -111.65 99.86 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.497 -0.752 . . . . 0.0 109.803 178.57 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.92 174.86 5.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.656 -1.278 . . . . 0.0 110.424 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.1 p -107.8 152.93 23.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.402 -0.811 . . . . 0.0 110.149 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -161.45 178.49 37.34 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -147.97 139.39 23.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.25 -1.147 . . . . 0.0 110.256 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.0 mtm -126.36 139.14 53.52 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.13 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.89 101.71 6.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.416 ' OXT' HG23 ' B' ' 81' ' ' ILE . 4.1 mt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.07 -0.966 . . . . 0.0 110.207 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.445 ' HB3' ' HB3' ' A' ' 78' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.297 0.57 . . . . 0.0 110.138 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 66.8 p -96.23 106.68 30.4 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.384 -179.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -52.82 155.7 10.42 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 O-C-N 124.034 1.544 . . . . 0.0 110.315 179.815 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.414 HG12 ' C ' ' A' ' 77' ' ' GLY . 7.1 pt -143.47 178.69 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.534 HG13 ' CG1' ' A' ' 74' ' ' VAL . 40.3 t -145.53 136.04 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.281 -0.887 . . . . 0.0 110.381 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.522 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.54 121.4 43.88 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.329 -0.857 . . . . 0.0 109.795 179.647 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.461 ' HB2' HG12 ' A' ' 49' ' ' VAL . 0.4 OUTLIER -115.51 123.81 49.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.546 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.521 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 18.8 tttt -141.48 166.22 25.35 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.236 -0.915 . . . . 0.0 110.209 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.521 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 141.88 -146.07 16.87 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.92 121.38 14.51 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.322 -1.105 . . . . 0.0 110.332 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.18 -35.96 28.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.354 -0.841 . . . . 0.0 110.733 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -75.01 -43.79 51.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.154 -0.966 . . . . 0.0 110.64 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.435 ' O ' HD11 ' A' ' 17' ' ' LEU . 47.6 m -57.86 -27.01 62.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.206 -0.934 . . . . 0.0 110.507 -179.792 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.421 ' CD2' HD11 ' A' ' 72' ' ' ILE . 15.7 mt -82.67 -34.45 27.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -59.78 -39.12 83.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 110.117 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.485 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 35.9 t -70.21 -37.84 75.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.407 -0.808 . . . . 0.0 110.571 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.435 HD11 ' O ' ' A' ' 13' ' ' THR . 22.7 mt -58.66 -50.56 73.41 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.086 -1.009 . . . . 0.0 110.166 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 18.1 ttm105 -46.98 -29.15 1.91 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.367 -0.833 . . . . 0.0 110.307 179.867 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.485 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 72.0 t80 -64.81 -42.12 95.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.234 -0.916 . . . . 0.0 110.503 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 mtt-85 -70.99 -26.24 63.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.926 . . . . 0.0 110.157 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.581 ' CE1' HG12 ' A' ' 66' ' ' VAL . 9.1 m-30 -66.55 -20.37 66.0 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.217 -0.927 . . . . 0.0 110.398 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -63.29 -27.7 69.51 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.224 -0.923 . . . . 0.0 110.42 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.6 mmtm -75.13 -48.4 23.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.476 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.408 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 20.1 m-70 -94.84 52.85 1.53 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.204 -0.935 . . . . 0.0 110.228 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.4 p -57.7 -13.65 4.38 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.154 -0.966 . . . . 0.0 110.742 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.86 13.4 28.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.025 -1.047 . . . . 0.0 110.699 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.423 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 3.6 mt -92.06 -45.11 8.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.122 -0.986 . . . . 0.0 110.089 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.631 ' CE2' ' CG2' ' A' ' 31' ' ' VAL . 28.6 p90 -106.12 172.66 6.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.328 -0.857 . . . . 0.0 109.584 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -100.41 -35.52 9.54 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.864 -1.148 . . . . 0.0 110.99 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 119.84 2.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.091 -1.006 . . . . 0.0 110.81 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.631 ' CG2' ' CE2' ' A' ' 28' ' ' TYR . 47.1 t -88.42 99.96 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.309 -0.869 . . . . 0.0 110.18 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.769 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -62.12 151.28 36.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 111.663 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.456 ' OG ' ' N ' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -61.69 159.1 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.441 -0.787 . . . . 0.0 109.761 179.023 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.2 127.6 33.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.771 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 58.6 p-90 -146.39 120.63 9.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.085 -1.009 . . . . 0.0 110.634 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.631 ' CD2' ' N ' ' A' ' 37' ' ' TRP . 20.2 t60 -78.94 166.44 22.38 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.032 -1.043 . . . . 0.0 109.913 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.631 ' N ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -78.41 50.7 0.96 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.817 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.589 HG21 ' CD2' ' A' ' 36' ' ' HIS . 13.0 t -150.83 165.49 33.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.149 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.449 ' O ' ' CB ' ' A' ' 40' ' ' HIS . . . -133.15 -170.17 12.37 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.449 ' CB ' ' O ' ' A' ' 39' ' ' GLY . 1.5 t-80 65.6 -131.3 0.24 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.38 -1.071 . . . . 0.0 110.196 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.414 ' H ' ' CG ' ' A' ' 40' ' ' HIS . 9.4 t-20 -146.02 96.86 2.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.996 -1.065 . . . . 0.0 110.183 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 2.7 m -107.11 140.01 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.217 -0.927 . . . . 0.0 110.153 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.9 mttt -75.13 -25.19 58.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.234 -0.916 . . . . 0.0 110.215 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -57.12 133.1 54.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.285 -0.884 . . . . 0.0 110.144 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -50.46 150.27 2.73 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.288 -0.882 . . . . 0.0 110.424 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.53 ' HB2' ' CB ' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -167.82 131.09 1.64 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.224 -0.923 . . . . 0.0 110.106 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -164.43 108.23 0.93 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.218 -0.926 . . . . 0.0 110.567 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.516 ' O ' ' O ' ' A' ' 35' ' ' TRP . 80.1 mt -142.27 133.75 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.22 -0.925 . . . . 0.0 110.068 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.508 ' CG2' ' O ' ' A' ' 32' ' ' SER . 0.3 OUTLIER -125.14 -179.38 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.9 -1.125 . . . . 0.0 110.308 -179.932 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.412 ' N ' HG11 ' A' ' 49' ' ' VAL . 16.8 m -145.06 158.2 43.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.409 -0.807 . . . . 0.0 109.818 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 27.0 mt -135.04 131.52 37.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.231 -0.918 . . . . 0.0 110.009 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.447 ' CG2' ' CZ2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.83 130.56 44.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 110.263 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -117.8 152.86 34.48 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.387 -0.82 . . . . 0.0 109.986 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -95.48 -18.35 20.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.362 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 77.3 p -145.43 140.44 27.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -61.12 -39.58 90.55 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 0.0 110.226 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.9 t-105 -53.96 -50.45 66.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.286 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.423 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 60.2 tt0 -57.27 -40.1 77.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.424 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.439 ' HD2' HD13 ' A' ' 63' ' ' LEU . 5.1 tmm_? -59.32 -38.99 81.7 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.128 -0.983 . . . . 0.0 110.168 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 42.6 m-20 -61.34 -41.42 97.01 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.865 . . . . 0.0 110.53 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.465 ' O ' ' OG ' ' A' ' 64' ' ' SER . 50.2 mt-30 -65.7 -40.08 91.91 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.159 -0.963 . . . . 0.0 110.201 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.477 ' CE2' HG22 ' A' ' 66' ' ' VAL . 68.3 t80 -55.76 -42.07 74.92 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.263 -0.898 . . . . 0.0 109.942 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.439 HD13 ' HD2' ' A' ' 59' ' ' ARG . 12.0 mt -59.44 -24.0 63.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' SER . . . . . 0.465 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 3.7 p -100.08 -7.89 24.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 110.179 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.6 mt-30 -97.07 -29.31 13.7 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.314 -0.867 . . . . 0.0 109.818 179.746 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.581 HG12 ' CE1' ' A' ' 21' ' ' PHE . 19.1 m -110.04 85.36 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.644 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -35.59 104.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.557 -0.715 . . . . 0.0 110.479 -179.517 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.496 HG13 ' O ' ' A' ' 66' ' ' VAL . 82.3 mt -87.67 115.03 61.61 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.176 -0.953 . . . . 0.0 110.467 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -63.4 -158.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 124.073 1.565 . . . . 0.0 110.082 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -106.54 -13.1 15.42 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.108 -0.995 . . . . 0.0 110.328 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.2 p -84.59 -21.97 30.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.421 HD11 ' CD2' ' A' ' 14' ' ' LEU . 25.1 mm -93.75 108.34 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.285 -0.884 . . . . 0.0 109.858 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.7 m -96.14 153.72 17.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.192 -0.943 . . . . 0.0 110.241 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.534 ' CG1' HG13 ' A' ' 5' ' ' VAL . 6.9 t -145.26 156.17 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.228 -0.92 . . . . 0.0 110.717 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -138.42 -179.07 5.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.51 -0.744 . . . . 0.0 110.061 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.462 ' O ' ' HB3' ' B' ' 80' ' ' SER . 1.6 p -106.31 154.54 20.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.201 -0.937 . . . . 0.0 110.467 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.414 ' C ' HG12 ' A' ' 4' ' ' ILE . . . -161.13 175.3 37.78 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.445 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 79.7 m-85 -147.92 137.88 22.68 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.182 -1.187 . . . . 0.0 110.44 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 7.9 mtt -115.14 162.2 17.37 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.342 -0.849 . . . . 0.0 109.814 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 12.4 t -118.66 99.37 6.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.23 179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 1.7 pt . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.248 179.935 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.436 ' HB3' ' HB3' ' B' ' 78' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.213 0.53 . . . . 0.0 110.224 . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 63.6 p -96.77 106.5 30.72 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.204 -0.935 . . . . 0.0 110.308 -179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.408 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 48.4 Cg_endo -52.54 155.96 9.3 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.021 1.538 . . . . 0.0 110.302 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.429 HG12 ' C ' ' B' ' 77' ' ' GLY . 7.6 pt -143.4 178.48 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.203 -0.936 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.539 HG13 ' CG1' ' B' ' 74' ' ' VAL . 39.8 t -145.64 136.04 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.878 . . . . 0.0 110.257 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.518 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.94 121.1 43.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.365 -0.834 . . . . 0.0 109.783 179.857 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.47 ' HB2' HG12 ' B' ' 49' ' ' VAL . 0.5 OUTLIER -115.08 124.23 51.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.57 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.519 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 18.8 tttt -141.38 166.08 25.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -0.879 . . . . 0.0 110.196 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.519 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 142.04 -146.3 17.21 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.68 121.85 15.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.346 -1.091 . . . . 0.0 110.324 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.71 -35.49 31.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 110.725 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -75.42 -43.59 49.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.175 -0.953 . . . . 0.0 110.561 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.411 ' O ' HD11 ' B' ' 17' ' ' LEU . 44.4 m -57.86 -28.18 63.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.173 -0.954 . . . . 0.0 110.403 -179.757 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.466 ' HG ' HD11 ' B' ' 72' ' ' ILE . 13.0 mt -81.9 -34.66 29.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.077 -1.015 . . . . 0.0 110.117 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -59.74 -38.85 82.88 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.326 -0.859 . . . . 0.0 110.171 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.483 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 36.3 t -70.2 -37.71 75.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 0.0 110.485 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.411 HD11 ' O ' ' B' ' 13' ' ' THR . 23.0 mt -58.76 -50.61 73.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.142 -0.974 . . . . 0.0 110.107 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -47.16 -28.65 1.91 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.433 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.483 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 72.0 t80 -64.84 -41.92 95.34 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.317 -0.864 . . . . 0.0 110.469 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 26.2 mtt-85 -71.27 -26.42 62.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.0 110.364 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.581 ' CE1' HG12 ' B' ' 66' ' ' VAL . 8.5 m-30 -66.64 -20.17 65.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.27 -0.894 . . . . 0.0 110.359 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -63.38 -27.44 69.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.139 -0.976 . . . . 0.0 110.459 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -75.16 -48.32 24.18 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.264 -0.898 . . . . 0.0 110.512 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.401 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 18.9 m-70 -94.93 52.88 1.51 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.249 -0.907 . . . . 0.0 110.22 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 p -57.47 -13.72 3.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.29 -0.881 . . . . 0.0 110.558 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.96 13.58 28.42 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.128 -0.982 . . . . 0.0 110.817 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.425 ' O ' ' NE2' ' B' ' 58' ' ' GLN . 3.6 mt -92.32 -44.13 8.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.071 -1.018 . . . . 0.0 109.97 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.628 ' CE2' ' CG2' ' B' ' 31' ' ' VAL . 27.8 p90 -107.14 173.33 6.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.256 -0.903 . . . . 0.0 109.536 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.2 m -100.86 -35.79 9.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.054 -1.029 . . . . 0.0 110.919 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.76 119.86 2.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.165 -0.959 . . . . 0.0 110.684 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.628 ' CG2' ' CE2' ' B' ' 28' ' ' TYR . 48.5 t -88.19 99.68 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.089 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.771 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -60.78 150.13 33.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 111.485 -179.49 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' SER . . . . . 0.443 ' OG ' ' N ' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -61.7 159.65 13.1 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.551 -0.718 . . . . 0.0 109.575 179.107 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -68.25 127.41 32.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.036 -1.04 . . . . 0.0 110.616 -179.955 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.769 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 58.4 p-90 -146.22 120.73 9.72 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.024 -1.047 . . . . 0.0 110.701 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.636 ' CD2' ' N ' ' B' ' 37' ' ' TRP . 20.9 t60 -78.86 166.48 22.38 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.933 -1.104 . . . . 0.0 109.902 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.636 ' N ' ' CD2' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -78.57 50.93 1.01 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.102 -0.998 . . . . 0.0 110.129 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' THR . . . . . 0.578 HG21 ' CD2' ' B' ' 36' ' ' HIS . 13.6 t -150.71 169.95 20.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.32 -0.863 . . . . 0.0 110.184 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . 0.459 ' O ' ' CB ' ' B' ' 40' ' ' HIS . . . -137.09 -171.32 12.15 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . 0.459 ' CB ' ' O ' ' B' ' 39' ' ' GLY . 1.5 t-80 66.0 -131.79 0.21 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.285 -1.127 . . . . 0.0 110.18 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . 0.417 ' H ' ' CG ' ' B' ' 40' ' ' HIS . 11.8 t-20 -145.11 97.44 3.01 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.981 -1.074 . . . . 0.0 110.293 -179.797 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.7 m -107.71 140.64 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.278 -0.889 . . . . 0.0 109.912 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -75.74 -25.33 56.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.184 -0.947 . . . . 0.0 110.184 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -56.48 132.59 51.77 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.207 -0.933 . . . . 0.0 110.228 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -50.22 150.33 2.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.293 -0.88 . . . . 0.0 110.297 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.509 ' CB ' ' CG ' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -167.62 132.88 1.94 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.335 -0.853 . . . . 0.0 110.095 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -166.38 108.61 0.72 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.164 -0.96 . . . . 0.0 110.583 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.528 ' O ' ' O ' ' B' ' 35' ' ' TRP . 85.3 mt -142.38 134.23 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.326 -0.859 . . . . 0.0 109.799 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . 0.526 ' CG2' ' O ' ' B' ' 32' ' ' SER . 0.3 OUTLIER -125.91 -179.4 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.841 -1.162 . . . . 0.0 110.306 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 17.1 m -145.03 158.43 43.82 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.318 -0.863 . . . . 0.0 109.97 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 25.2 mt -134.97 131.44 37.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.23 -0.919 . . . . 0.0 109.982 179.954 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.554 ' CG2' ' CZ2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.62 130.77 43.76 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.313 -0.867 . . . . 0.0 110.167 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.408 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 35.5 m-85 -118.07 153.3 33.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.346 -0.846 . . . . 0.0 110.003 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -95.4 -18.49 20.69 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.25 -0.906 . . . . 0.0 110.397 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 p -145.32 140.33 27.66 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.152 -0.967 . . . . 0.0 110.307 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.1 -39.3 89.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.288 -0.883 . . . . 0.0 110.044 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -54.12 -50.99 65.64 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.232 -0.917 . . . . 0.0 110.237 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.425 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 60.9 tt0 -57.08 -39.7 75.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.409 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.445 ' HD2' HD13 ' B' ' 63' ' ' LEU . 5.1 tmm_? -59.69 -38.86 82.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.085 -1.009 . . . . 0.0 110.006 179.685 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.416 -0.803 . . . . 0.0 110.441 -179.841 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.457 ' O ' ' OG ' ' B' ' 64' ' ' SER . 52.0 mt-30 -65.83 -40.0 91.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.252 -0.905 . . . . 0.0 110.283 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.458 ' CE2' HG22 ' B' ' 66' ' ' VAL . 69.5 t80 -55.83 -41.68 74.6 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 109.754 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.445 HD13 ' HD2' ' B' ' 59' ' ' ARG . 13.0 mt -59.51 -24.58 63.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.336 -0.852 . . . . 0.0 110.049 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.457 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 3.9 p -99.87 -7.9 24.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.299 -0.876 . . . . 0.0 110.144 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . 0.408 ' NE2' ' CD1' ' B' ' 27' ' ' LEU . 3.5 mt-30 -97.08 -29.13 13.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.303 -0.873 . . . . 0.0 109.881 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.581 HG12 ' CE1' ' B' ' 21' ' ' PHE . 20.3 m -110.0 83.58 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.323 -0.861 . . . . 0.0 109.912 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . 0.55 ' CG ' ' O ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -33.47 104.14 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.497 -0.752 . . . . 0.0 110.627 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.484 HG13 ' O ' ' B' ' 66' ' ' VAL . 84.8 mt -87.89 114.49 59.38 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 110.534 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.75 -159.03 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.845 0 O-C-N 124.211 1.637 . . . . 0.0 110.236 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -106.24 -12.84 15.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.184 -0.948 . . . . 0.0 110.492 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 29.9 p -84.69 -21.97 29.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.161 -0.962 . . . . 0.0 110.13 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.466 HD11 ' HG ' ' B' ' 14' ' ' LEU . 24.8 mm -94.12 108.5 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.287 -0.883 . . . . 0.0 109.751 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -96.09 153.64 17.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.109 -0.995 . . . . 0.0 110.07 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.539 ' CG1' HG13 ' B' ' 5' ' ' VAL . 6.0 t -144.99 155.98 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.107 -0.995 . . . . 0.0 110.546 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 3.3 t -138.6 -178.92 5.52 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.154 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -106.15 154.04 21.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.306 -0.871 . . . . 0.0 110.592 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . 0.429 ' C ' HG12 ' B' ' 4' ' ' ILE . . . -160.75 174.91 37.47 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.436 ' HB3' ' HB3' ' B' ' 1' ' ' MET . 80.1 m-85 -147.99 138.07 22.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.212 -1.169 . . . . 0.0 110.416 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 7.7 mtt -115.3 161.69 18.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.208 -0.933 . . . . 0.0 109.935 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.462 ' HB3' ' O ' ' A' ' 76' ' ' THR . 13.1 t -118.37 98.95 6.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.184 -0.948 . . . . 0.0 110.168 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 1.6 pt . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.069 179.827 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 mtp . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.253 0.549 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.476 ' O ' HG21 ' A' ' 2' ' ' THR . 5.5 t -100.95 103.83 27.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.274 -0.891 . . . . 0.0 110.419 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 48.8 Cg_endo -49.33 157.94 1.83 Allowed 'Trans proline' 0 C--N 1.305 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.238 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.467 ' CD1' ' O ' ' A' ' 4' ' ' ILE . 2.3 pp -143.91 119.02 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.131 -0.981 . . . . 0.0 110.488 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.453 HG12 HG21 ' A' ' 74' ' ' VAL . 1.2 t -94.08 136.57 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.226 -0.921 . . . . 0.0 110.257 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.54 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.47 138.62 41.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.301 -0.874 . . . . 0.0 109.695 179.529 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.46 ' HG ' ' CG2' ' A' ' 72' ' ' ILE . 0.3 OUTLIER -129.57 131.13 46.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.958 -1.089 . . . . 0.0 110.569 -179.55 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.468 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 14.4 ttpp -141.52 167.02 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.29 -0.881 . . . . 0.0 109.951 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.461 ' O ' ' HB3' ' A' ' 46' ' ' SER . . . 145.6 -151.06 23.31 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.781 -1.327 . . . . 0.0 109.781 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.411 ' O ' ' HB ' ' A' ' 13' ' ' THR . 8.3 m-20 -65.33 127.22 30.88 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.317 -1.108 . . . . 0.0 110.715 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.466 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.32 -68.81 0.14 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 0.0 110.398 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -46.0 -43.61 14.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 110.177 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.475 ' O ' HD12 ' A' ' 17' ' ' LEU . 22.3 m -57.94 -18.25 22.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 110.104 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.496 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 19.7 mt -91.53 -29.88 16.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.306 -0.871 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.0 mmtt -59.03 -41.43 87.77 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.204 -0.935 . . . . 0.0 110.481 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 t -69.74 -36.49 75.89 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.381 -0.824 . . . . 0.0 110.547 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.496 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 46.0 mt -58.92 -54.49 46.55 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.04 -1.038 . . . . 0.0 110.36 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -45.81 -32.1 2.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.307 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.82 -29.34 70.29 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.215 -0.928 . . . . 0.0 110.213 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -69.87 -21.8 63.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.025 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.441 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.2 m-30 -66.47 -36.41 82.68 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 110.045 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -63.61 -33.79 76.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.429 -0.795 . . . . 0.0 110.218 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -74.96 -9.43 58.53 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.207 -0.933 . . . . 0.0 109.863 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 99.1 m-70 -145.04 43.53 1.33 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.831 179.739 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.47 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.8 t -57.74 -8.58 0.95 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.421 -0.8 . . . . 0.0 111.039 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.6 p -95.78 7.69 45.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.93 -1.106 . . . . 0.0 110.292 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.509 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 5.0 mt -92.33 -54.87 3.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 0.0 109.864 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.47 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 31.7 p90 -93.65 169.84 10.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.1 m -100.61 -33.24 10.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.081 -1.012 . . . . 0.0 110.811 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.49 114.7 2.44 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.959 -1.088 . . . . 0.0 110.748 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.468 HG22 ' O ' ' A' ' 31' ' ' VAL . 20.5 m -90.57 112.9 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 110.187 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.567 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -68.45 147.94 51.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.157 -0.964 . . . . 0.0 110.342 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.48 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -61.5 159.64 12.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.433 ' HA ' HG21 ' A' ' 49' ' ' VAL . 91.7 m -68.18 134.86 51.16 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.356 -0.84 . . . . 0.0 110.447 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.587 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 60.2 p-90 -146.66 -178.39 6.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 0.0 109.564 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.576 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 70.6 t60 -162.43 174.23 13.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.893 -1.129 . . . . 0.0 110.66 -179.392 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 74.7 m95 -78.65 103.41 8.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.274 -0.891 . . . . 0.0 110.281 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 3.0 p -117.79 -179.49 3.76 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.349 -0.844 . . . . 0.0 110.217 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -174.2 -89.35 0.07 OUTLIER Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -138.66 -62.9 0.55 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.432 -1.04 . . . . 0.0 110.127 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.439 ' C ' HG12 ' A' ' 42' ' ' VAL . 36.4 m120 -102.49 99.97 10.04 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.268 -0.895 . . . . 0.0 110.185 179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.439 HG12 ' C ' ' A' ' 41' ' ' ASN . 27.0 m -136.15 144.63 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.268 -0.895 . . . . 0.0 110.187 179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.6 mtpt -94.14 -91.66 0.19 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 110.292 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.541 ' CG ' ' O ' ' A' ' 44' ' ' HIS . 31.0 p-80 -149.36 120.27 7.64 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.189 -0.945 . . . . 0.0 110.132 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -118.73 -123.38 0.29 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.217 -0.927 . . . . 0.0 110.344 -179.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.461 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 0.1 OUTLIER -146.18 108.13 4.36 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.027 -1.046 . . . . 0.0 110.573 -179.747 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.487 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -39.16 157.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.492 -0.755 . . . . 0.0 110.567 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.531 ' N ' ' O ' ' A' ' 35' ' ' TRP . 45.9 mt -143.85 148.48 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.41 -0.806 . . . . 0.0 109.939 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.433 HG21 ' HA ' ' A' ' 34' ' ' THR . 0.4 OUTLIER -128.16 -179.48 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.1 -1.0 . . . . 0.0 110.276 -179.899 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.507 HG23 ' N ' ' A' ' 51' ' ' LEU . 96.4 m -145.98 154.05 41.47 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.256 -0.903 . . . . 0.0 110.009 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.507 ' N ' HG23 ' A' ' 50' ' ' THR . 17.7 mt -132.91 124.09 27.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.148 -0.97 . . . . 0.0 110.24 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 132.88 42.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.28 -0.887 . . . . 0.0 110.263 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.509 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 45.0 m-85 -117.73 153.87 32.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -0.876 . . . . 0.0 110.188 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -85.25 -9.99 57.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 110.574 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -162.46 160.43 26.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.135 -0.978 . . . . 0.0 110.238 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -70.99 -37.85 72.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.18 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -53.97 -52.38 60.87 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 21.5 tt0 -58.08 -36.03 72.26 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.335 -0.853 . . . . 0.0 110.624 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp85 -59.13 -54.13 50.46 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.101 -0.999 . . . . 0.0 110.601 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -61.05 -26.34 67.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.201 -0.937 . . . . 0.0 110.364 -179.661 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.45 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 46.7 mt-30 -65.54 -54.89 21.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 109.785 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.556 ' CE1' ' CG2' ' A' ' 66' ' ' VAL . 1.8 t80 -55.63 -39.74 71.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.905 . . . . 0.0 109.832 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 9.2 mt -59.19 -23.64 62.42 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 110.068 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.71 -18.69 21.06 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.31 -0.869 . . . . 0.0 110.149 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -93.93 -9.05 38.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.178 -0.951 . . . . 0.0 109.89 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.556 ' CG2' ' CE1' ' A' ' 62' ' ' PHE . 34.0 m -136.41 133.09 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.367 -0.833 . . . . 0.0 109.811 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 103.08 11.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.241 -0.912 . . . . 0.0 109.785 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.547 ' CG2' ' HD2' ' A' ' 69' ' ' PRO . 18.1 mt -88.08 130.94 44.4 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.437 -0.789 . . . . 0.0 110.336 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.547 ' HD2' ' CG2' ' A' ' 68' ' ' ILE . 41.6 Cg_endo -40.53 162.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.639 0 O-C-N 123.969 1.51 . . . . 0.0 110.463 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -74.99 3.35 8.5 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.298 -0.876 . . . . 0.0 110.882 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -24.87 28.79 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.043 -1.035 . . . . 0.0 109.842 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.512 HD13 ' CG2' ' A' ' 68' ' ' ILE . 81.2 mt -95.41 109.11 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.51 -0.743 . . . . 0.0 110.503 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.506 HG22 ' N ' ' A' ' 74' ' ' VAL . 79.4 m -96.14 157.0 16.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.219 -0.926 . . . . 0.0 110.451 179.851 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.54 ' HA ' ' O ' ' A' ' 6' ' ' HIS . 3.4 p -143.07 136.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.106 -0.996 . . . . 0.0 111.409 -179.086 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.427 ' C ' HG22 ' A' ' 76' ' ' THR . 0.4 OUTLIER -102.23 -179.53 4.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.294 0.568 . . . . 0.0 110.141 179.799 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.427 HG22 ' C ' ' A' ' 75' ' ' SER . 50.2 p -128.94 154.33 46.66 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.306 -0.871 . . . . 0.0 109.96 179.752 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -171.54 -170.33 35.46 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.414 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 56.2 m-85 -147.53 150.63 34.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.355 -1.085 . . . . 0.0 110.32 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.472 ' HE3' HD12 ' B' ' 4' ' ' ILE . 1.1 ttt -124.61 167.61 14.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.235 -0.915 . . . . 0.0 109.989 179.718 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 27.4 t -131.47 103.68 6.56 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.0 110.309 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.456 HG12 ' O ' ' A' ' 81' ' ' ILE . 6.5 tt . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.257 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 mtp . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.247 0.546 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.476 ' O ' HG21 ' B' ' 2' ' ' THR . 5.4 t -101.31 104.46 33.47 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 110.401 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.5 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -50.16 157.63 2.86 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 123.974 1.513 . . . . 0.0 110.114 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.472 HD12 ' HE3' ' A' ' 79' ' ' MET . 2.3 pp -143.87 119.05 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.217 -0.927 . . . . 0.0 110.325 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.409 HG12 HG21 ' B' ' 74' ' ' VAL . 1.1 t -94.11 136.11 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.262 -0.899 . . . . 0.0 110.301 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.519 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.2 138.57 41.19 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.29 -0.881 . . . . 0.0 109.666 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.468 ' HG ' ' CG2' ' B' ' 72' ' ' ILE . 0.3 OUTLIER -129.77 131.4 46.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.004 -1.06 . . . . 0.0 110.607 -179.484 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.467 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 15.0 ttpp -141.43 167.17 22.8 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.983 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.458 ' O ' ' HB3' ' B' ' 46' ' ' SER . . . 145.66 -151.53 23.72 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . 0.402 ' O ' ' HB ' ' B' ' 13' ' ' THR . 9.6 m-20 -64.93 127.25 30.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.275 -1.132 . . . . 0.0 110.655 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.469 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.34 -68.99 0.13 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.275 -0.89 . . . . 0.0 110.282 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . 0.411 ' OD1' ' N ' ' B' ' 13' ' ' THR . 10.3 p30 -45.71 -43.93 13.2 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.48 ' O ' HD12 ' B' ' 17' ' ' LEU . 22.2 m -57.83 -18.02 19.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.289 -0.882 . . . . 0.0 110.096 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.491 ' HA ' ' CD1' ' B' ' 17' ' ' LEU . 18.6 mt -91.74 -29.63 16.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.254 -0.904 . . . . 0.0 110.337 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.5 mmtt -59.17 -41.17 87.8 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.331 -0.856 . . . . 0.0 110.519 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 15.8 t -69.96 -36.56 75.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.368 -0.832 . . . . 0.0 110.564 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.491 ' CD1' ' HA ' ' B' ' 14' ' ' LEU . 44.4 mt -59.04 -54.12 50.68 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.115 -0.991 . . . . 0.0 110.495 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -46.08 -31.99 2.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.838 . . . . 0.0 110.332 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.89 -29.85 70.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.161 -0.962 . . . . 0.0 110.081 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -69.6 -21.95 63.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.262 -0.899 . . . . 0.0 110.008 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.432 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 10.2 m-30 -66.48 -36.3 82.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.87 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -63.71 -34.0 76.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.377 -0.827 . . . . 0.0 110.222 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -74.88 -9.3 58.41 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.161 -0.962 . . . . 0.0 109.753 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 99.0 m-70 -145.16 43.66 1.32 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.379 -0.826 . . . . 0.0 109.948 179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.454 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.8 t -57.73 -8.9 1.02 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.341 -0.849 . . . . 0.0 111.136 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 68.9 p -95.38 7.62 45.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.959 -1.088 . . . . 0.0 110.327 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.482 ' O ' ' NE2' ' B' ' 58' ' ' GLN . 5.0 mt -92.41 -54.49 3.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.878 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.454 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 31.6 p90 -93.7 169.46 10.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.273 -0.892 . . . . 0.0 109.779 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 5.5 m -100.53 -33.15 10.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.116 -0.99 . . . . 0.0 110.815 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.44 114.55 2.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.1 -1.0 . . . . 0.0 110.843 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.403 HG12 ' CD2' ' B' ' 51' ' ' LEU . 17.0 m -90.6 111.63 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.405 -0.809 . . . . 0.0 110.119 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.587 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -67.6 148.33 51.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.11 -0.994 . . . . 0.0 110.502 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' SER . . . . . 0.467 ' HB3' ' O ' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -61.6 158.96 14.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.344 -0.847 . . . . 0.0 110.245 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.409 ' HA ' HG21 ' B' ' 49' ' ' VAL . 86.1 m -68.18 134.9 51.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.317 -0.864 . . . . 0.0 110.602 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.567 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 59.5 p-90 -146.75 -178.17 6.04 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 109.549 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.583 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 70.4 t60 -162.35 174.44 12.79 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.828 -1.17 . . . . 0.0 110.685 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.583 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 73.5 m95 -78.54 103.57 8.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.183 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 3.0 p -118.28 -179.81 3.89 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.268 -0.895 . . . . 0.0 110.167 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -173.95 -89.67 0.08 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -138.17 -62.82 0.57 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.334 -1.098 . . . . 0.0 110.163 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . 0.436 ' C ' HG12 ' B' ' 42' ' ' VAL . 36.5 m120 -102.56 99.55 9.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.216 -0.928 . . . . 0.0 110.154 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.436 HG12 ' C ' ' B' ' 41' ' ' ASN . 28.3 m -135.59 143.85 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.259 -0.901 . . . . 0.0 110.128 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -93.36 -92.51 0.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.364 -0.835 . . . . 0.0 110.078 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . 0.518 ' O ' ' CG ' ' B' ' 44' ' ' HIS . 31.9 p-80 -148.28 122.03 9.28 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.087 -1.008 . . . . 0.0 110.111 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -120.09 -122.37 0.29 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.227 -0.921 . . . . 0.0 110.429 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.458 ' HB3' ' O ' ' B' ' 9' ' ' GLY . 0.1 OUTLIER -147.02 107.64 4.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.993 -1.067 . . . . 0.0 110.641 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.489 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -39.0 157.31 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.415 -0.803 . . . . 0.0 110.44 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.537 ' N ' ' O ' ' B' ' 35' ' ' TRP . 44.5 mt -143.93 148.22 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 0.0 110.024 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . 0.409 HG21 ' HA ' ' B' ' 34' ' ' THR . 0.4 OUTLIER -127.47 -179.33 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.134 -0.979 . . . . 0.0 110.193 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.502 HG23 ' N ' ' B' ' 51' ' ' LEU . 93.4 m -145.73 154.27 41.87 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.502 ' N ' HG23 ' B' ' 50' ' ' THR . 18.9 mt -133.14 123.53 25.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.052 -1.03 . . . . 0.0 110.207 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.12 133.69 41.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 110.201 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.5 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 44.2 m-85 -118.91 154.41 33.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.275 -0.891 . . . . 0.0 110.226 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.09 -10.66 56.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 0.0 110.522 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -162.16 160.71 27.51 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.08 -1.012 . . . . 0.0 110.434 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.408 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 78.5 mt-10 -70.72 -38.81 73.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.238 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -53.63 -52.18 60.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 110.229 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.482 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 21.9 tt0 -58.25 -35.93 72.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.602 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.408 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 13.2 ttp85 -59.19 -54.33 48.21 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.054 -1.028 . . . . 0.0 110.68 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -61.0 -26.1 67.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 110.295 -179.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.463 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 45.3 mt-30 -65.54 -54.89 21.64 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.22 -0.925 . . . . 0.0 109.915 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.563 ' CE1' ' CG2' ' B' ' 66' ' ' VAL . 1.7 t80 -55.67 -39.95 71.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.833 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 9.0 mt -59.19 -23.61 62.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.3 -0.875 . . . . 0.0 110.044 -179.966 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.22 -18.95 21.18 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.217 -0.927 . . . . 0.0 110.362 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -94.43 -8.34 38.88 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.209 -0.932 . . . . 0.0 110.042 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.563 ' CG2' ' CE1' ' B' ' 62' ' ' PHE . 33.6 m -136.7 132.79 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.362 -0.836 . . . . 0.0 109.676 179.512 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 103.05 11.19 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.346 -0.846 . . . . 0.0 109.793 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.545 ' CG2' ' HD2' ' B' ' 69' ' ' PRO . 18.2 mt -87.98 130.67 45.61 Favored Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.297 -0.877 . . . . 0.0 110.215 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.545 ' HD2' ' CG2' ' B' ' 68' ' ' ILE . 40.7 Cg_endo -40.56 163.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 O-C-N 123.889 1.468 . . . . 0.0 110.501 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -75.47 3.03 10.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.334 -0.854 . . . . 0.0 111.008 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.56 -24.83 29.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.052 -1.03 . . . . 0.0 109.902 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.523 HD13 ' CG2' ' B' ' 68' ' ' ILE . 84.4 mt -95.55 108.6 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 110.417 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' THR . . . . . 0.516 HG22 ' N ' ' B' ' 74' ' ' VAL . 89.9 m -95.83 157.31 15.95 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.41 -179.958 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.519 ' HA ' ' O ' ' B' ' 6' ' ' HIS . 3.2 p -143.29 137.37 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 111.539 -179.003 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' SER . . . . . 0.426 ' C ' HG22 ' B' ' 76' ' ' THR . 0.4 OUTLIER -103.22 -179.4 3.94 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.343 0.592 . . . . 0.0 110.167 179.588 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' THR . . . . . 0.426 HG22 ' C ' ' B' ' 75' ' ' SER . 46.5 p -128.83 154.37 46.51 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 109.929 179.728 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . 0.419 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -171.72 -170.16 35.39 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.419 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 57.7 m-85 -147.58 151.25 35.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.33 -1.1 . . . . 0.0 110.284 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.425 ' HE3' HD12 ' A' ' 4' ' ' ILE . 1.0 OUTLIER -125.16 167.14 15.23 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 0.0 109.982 179.774 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 27.3 t -131.06 103.95 6.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.097 -1.002 . . . . 0.0 110.284 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.462 ' O ' HG12 ' B' ' 81' ' ' ILE . 6.7 tt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.232 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mtp . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.518 ' O ' ' CG2' ' A' ' 2' ' ' THR . 15.1 t -92.0 113.78 60.04 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.978 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.505 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -62.55 160.33 32.54 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.894 1.47 . . . . 0.0 110.281 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.472 HG21 ' O ' ' A' ' 3' ' ' PRO . 1.0 OUTLIER -143.29 122.37 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.372 -0.83 . . . . 0.0 109.939 179.736 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.551 ' CG1' HG21 ' A' ' 74' ' ' VAL . 85.5 t -94.28 130.08 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.2 -0.937 . . . . 0.0 110.616 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.507 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.83 122.22 45.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.245 -0.909 . . . . 0.0 109.729 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.526 ' HG ' ' CG2' ' A' ' 72' ' ' ILE . 0.7 OUTLIER -115.67 135.97 53.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 0.0 110.792 -179.35 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 4.3 ttpp -140.65 166.18 25.44 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.216 -0.928 . . . . 0.0 109.834 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.46 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 150.9 -156.14 26.52 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -64.97 130.66 44.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.344 -1.092 . . . . 0.0 110.666 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.516 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.54 -63.1 1.23 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.301 -0.874 . . . . 0.0 110.551 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -44.87 -47.29 11.14 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 0.0 110.58 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.445 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 97.0 m -57.77 -30.52 65.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.16 -0.963 . . . . 0.0 110.545 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.516 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 6.8 mt -70.59 -33.51 71.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.17 -0.956 . . . . 0.0 110.263 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.51 -44.14 93.22 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.237 -0.914 . . . . 0.0 110.753 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.441 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 21.5 t -69.82 -38.24 76.51 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.246 -0.909 . . . . 0.0 110.856 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.446 HD11 ' HA ' ' A' ' 14' ' ' LEU . 21.6 mt -58.81 -56.19 25.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.561 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -45.95 -28.22 1.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.0 110.29 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.441 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 61.0 t80 -64.82 -31.12 72.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.176 -0.953 . . . . 0.0 109.903 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -67.61 -21.77 65.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.317 -0.864 . . . . 0.0 110.07 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.468 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.2 m-30 -66.25 -36.43 82.99 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.026 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -63.52 -41.0 98.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.277 -0.889 . . . . 0.0 110.031 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.06 -2.09 25.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.188 -0.945 . . . . 0.0 109.847 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 84.8 m-70 -144.69 35.48 1.16 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.412 -0.805 . . . . 0.0 109.351 179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.513 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.6 t -57.55 -9.41 1.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.576 -0.702 . . . . 0.0 111.054 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.4 p -95.51 4.9 52.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.986 -1.071 . . . . 0.0 110.411 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.441 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 8.8 mt -92.59 -48.78 6.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.161 -0.962 . . . . 0.0 110.171 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.513 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 10.2 p90 -100.67 165.78 11.22 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.974 . . . . 0.0 109.755 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 m -101.33 -30.32 11.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.93 -1.106 . . . . 0.0 110.887 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.3 111.38 2.13 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.048 -1.033 . . . . 0.0 110.899 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.438 HG11 ' CD1' ' A' ' 28' ' ' TYR . 31.9 m -90.58 140.63 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.27 -0.894 . . . . 0.0 110.02 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.597 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.0 OUTLIER -90.89 145.56 24.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 162.12 8.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.247 -0.908 . . . . 0.0 110.43 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.5 m -68.32 132.5 47.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.276 -0.89 . . . . 0.0 110.475 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.619 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 55.5 p-90 -146.81 -178.33 6.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 109.826 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.638 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 25.6 t60 -162.35 174.43 12.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.001 -1.062 . . . . 0.0 110.719 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.638 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 34.4 m95 -78.57 98.28 6.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.519 -0.738 . . . . 0.0 110.024 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.41 ' O ' HG22 ' B' ' 31' ' ' VAL . 32.8 p -114.52 -178.46 3.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 110.225 -179.994 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -177.28 -103.87 0.17 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.261 -1.536 . . . . 0.0 109.261 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -117.22 -64.8 1.26 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.299 -1.118 . . . . 0.0 110.213 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -98.82 98.72 9.78 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.208 -0.933 . . . . 0.0 110.119 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 9.2 m -133.46 116.1 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.156 -0.965 . . . . 0.0 110.424 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -69.94 -80.14 0.05 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.234 -0.916 . . . . 0.0 109.93 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.575 ' CG ' ' O ' ' A' ' 44' ' ' HIS . 40.5 p-80 -165.4 119.7 1.25 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.363 -0.836 . . . . 0.0 109.929 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.592 ' HB2' ' CE1' ' A' ' 36' ' ' HIS . 15.4 mmtt -114.55 -133.37 0.34 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.281 -0.887 . . . . 0.0 110.352 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.449 ' HB2' ' O ' ' A' ' 9' ' ' GLY . 77.9 p -131.04 106.98 8.74 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.175 -0.953 . . . . 0.0 110.62 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.488 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -40.02 157.11 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.387 -0.82 . . . . 0.0 110.415 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.529 ' N ' ' O ' ' A' ' 35' ' ' TRP . 19.6 mt -143.95 167.81 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 110.032 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -147.16 -179.75 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.055 -1.028 . . . . 0.0 110.294 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.448 ' O ' ' OG ' ' A' ' 32' ' ' SER . 87.5 m -146.55 156.66 43.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.88 . . . . 0.0 109.945 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.449 HD22 ' CE2' ' A' ' 21' ' ' PHE . 1.5 mt -134.77 125.19 26.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.071 -1.018 . . . . 0.0 110.061 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 134.58 40.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.29 -0.882 . . . . 0.0 110.456 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.505 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 47.1 m-85 -120.25 154.83 34.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.232 -0.917 . . . . 0.0 110.308 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -86.4 -10.06 55.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 110.572 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.72 150.53 17.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.135 -0.978 . . . . 0.0 110.404 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.412 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 24.7 mt-10 -64.08 -39.08 93.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.898 . . . . 0.0 109.992 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.471 ' CD1' ' NE2' ' A' ' 61' ' ' GLN . 61.8 t-105 -53.57 -52.13 60.72 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.301 -0.874 . . . . 0.0 109.881 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.441 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 13.8 tt0 -57.37 -35.45 69.98 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.383 -0.823 . . . . 0.0 110.483 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.412 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 21.5 ttp85 -59.63 -50.45 73.81 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.083 -1.011 . . . . 0.0 110.966 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -60.93 -33.09 72.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.177 -0.952 . . . . 0.0 110.796 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.471 ' NE2' ' CD1' ' A' ' 57' ' ' TRP . 52.5 mt-30 -65.62 -47.34 75.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.158 -0.964 . . . . 0.0 110.207 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.461 ' C ' ' CD1' ' A' ' 62' ' ' PHE . 1.0 OUTLIER -55.69 -44.0 76.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 110.033 179.714 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.6 mt -59.22 -35.62 73.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.282 -0.886 . . . . 0.0 110.491 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.7 t -77.72 -18.9 56.07 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.147 -0.971 . . . . 0.0 110.449 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.478 ' O ' HG13 ' A' ' 66' ' ' VAL . 7.4 mm-40 -94.63 -9.44 35.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.621 -179.431 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.478 HG13 ' O ' ' A' ' 65' ' ' GLN . 27.5 m -141.91 92.92 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.042 -1.036 . . . . 0.0 110.545 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.513 ' O ' ' HG3' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -76.18 113.16 13.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.17 -0.956 . . . . 0.0 109.933 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.564 ' CG2' ' HD2' ' A' ' 69' ' ' PRO . 0.0 OUTLIER -89.76 162.94 34.5 Favored Pre-proline 0 N--CA 1.498 1.939 0 O-C-N 121.096 -1.003 . . . . 0.0 109.765 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.564 ' HD2' ' CG2' ' A' ' 68' ' ' ILE . 46.7 Cg_endo -60.93 -178.9 0.25 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.893 1.47 . . . . 0.0 110.133 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -91.97 -6.15 51.79 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 110.44 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.0 m -84.58 -20.35 31.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.0 110.022 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.526 ' CG2' ' HG ' ' A' ' 7' ' ' LEU . 33.0 mt -94.38 107.18 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.276 -0.89 . . . . 0.0 110.204 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -95.44 157.38 15.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 111.055 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.551 HG21 ' CG1' ' A' ' 5' ' ' VAL . 8.8 p -142.2 130.66 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.938 0.875 . . . . 0.0 111.24 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.75 172.79 6.64 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.311 0.577 . . . . 0.0 110.474 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.9 p -111.54 144.33 40.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.393 -0.817 . . . . 0.0 109.975 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -154.61 176.22 32.45 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -147.72 146.75 29.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.316 -1.108 . . . . 0.0 110.139 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 25.2 mtt -120.22 176.97 5.19 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.097 -1.002 . . . . 0.0 110.324 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.9 t -139.67 107.33 5.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.315 -0.866 . . . . 0.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.309 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mtp . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.217 0.532 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.516 ' CG2' ' O ' ' B' ' 2' ' ' THR . 15.2 t -92.21 113.82 60.35 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.23 -0.919 . . . . 0.0 109.94 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.504 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -62.4 160.15 32.72 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 123.999 1.526 . . . . 0.0 110.333 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.468 HG21 ' O ' ' B' ' 3' ' ' PRO . 1.0 OUTLIER -143.31 122.02 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.251 -0.906 . . . . 0.0 109.896 179.768 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.543 ' CG1' HG21 ' B' ' 74' ' ' VAL . 85.0 t -94.13 130.02 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.676 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.503 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.0 OUTLIER -105.5 122.97 47.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.279 -0.888 . . . . 0.0 109.565 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.54 ' HG ' ' CG2' ' B' ' 72' ' ' ILE . 0.7 OUTLIER -116.28 135.65 53.7 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.174 -0.954 . . . . 0.0 110.777 -179.427 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.48 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 4.4 ttpp -140.66 165.42 27.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 109.959 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.442 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 151.58 -155.78 26.33 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -65.0 130.96 45.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -1.117 . . . . 0.0 110.644 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.507 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.75 -62.66 1.47 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.393 -0.817 . . . . 0.0 110.613 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -45.64 -46.61 14.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 0.0 110.673 -179.603 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.447 HG23 HD12 ' B' ' 17' ' ' LEU . 97.1 m -58.09 -30.6 66.37 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.226 -0.921 . . . . 0.0 110.493 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.507 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 6.8 mt -70.83 -32.93 70.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 110.259 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.34 -44.44 92.64 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.295 -0.878 . . . . 0.0 110.651 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.434 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 16.4 t -70.14 -38.11 75.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.28 -0.888 . . . . 0.0 111.151 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.47 HD11 ' HA ' ' B' ' 14' ' ' LEU . 21.6 mt -58.65 -55.66 32.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.067 -1.02 . . . . 0.0 110.334 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -45.96 -29.05 1.29 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.264 -0.897 . . . . 0.0 110.251 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.434 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 60.0 t80 -64.76 -29.5 70.48 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.968 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -68.95 -21.58 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.32 -0.863 . . . . 0.0 110.015 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.482 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.5 m-30 -66.41 -36.94 84.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.897 . . . . 0.0 110.051 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -63.38 -40.83 98.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -75.05 -1.78 24.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.189 -0.944 . . . . 0.0 109.659 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 84.0 m-70 -144.86 35.19 1.13 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.443 -0.786 . . . . 0.0 109.421 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.518 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.7 t -57.61 -8.7 0.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.437 -0.789 . . . . 0.0 111.045 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 66.7 p -95.78 4.54 52.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.011 -1.056 . . . . 0.0 110.392 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 8.7 mt -92.32 -49.81 5.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 0.0 110.053 179.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.518 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 10.4 p90 -99.45 165.71 11.52 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 8.7 m -101.46 -30.96 11.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.037 -1.04 . . . . 0.0 110.969 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.37 111.63 2.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.072 -1.018 . . . . 0.0 110.71 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.442 HG11 ' CD1' ' B' ' 28' ' ' TYR . 32.9 m -90.59 143.35 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 110.127 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.619 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -92.09 144.99 24.87 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.15 -0.969 . . . . 0.0 110.459 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 161.7 9.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.381 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 15.7 m -68.09 132.14 46.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.279 -0.888 . . . . 0.0 110.508 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.597 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 56.1 p-90 -146.76 -177.97 5.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.876 . . . . 0.0 109.774 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.637 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 25.0 t60 -162.38 174.48 12.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.951 -1.093 . . . . 0.0 110.548 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.637 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 39.3 m95 -78.37 100.06 6.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.402 -0.811 . . . . 0.0 109.763 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 24.5 p -116.18 179.44 3.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.815 . . . . 0.0 110.314 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -175.7 -103.44 0.17 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.409 -1.477 . . . . 0.0 109.409 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -117.5 -65.49 1.18 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.276 -1.132 . . . . 0.0 110.194 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -98.08 99.46 10.73 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.191 -0.943 . . . . 0.0 110.101 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.428 HG22 ' O ' ' B' ' 42' ' ' VAL . 11.2 m -134.43 114.96 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.17 -0.956 . . . . 0.0 110.601 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 19.5 mtpt -68.48 -80.25 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.206 -0.934 . . . . 0.0 109.92 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . 0.574 ' O ' ' CG ' ' B' ' 44' ' ' HIS . 40.0 p-80 -165.27 120.67 1.34 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.33 -0.856 . . . . 0.0 109.917 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . 0.589 ' HB2' ' CE1' ' B' ' 36' ' ' HIS . 15.4 mmtt -115.65 -133.4 0.33 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.233 -0.917 . . . . 0.0 110.276 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.439 ' HB2' ' O ' ' B' ' 9' ' ' GLY . 76.8 p -130.96 106.9 8.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.041 -1.037 . . . . 0.0 110.614 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.489 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -40.21 157.1 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.4 -0.812 . . . . 0.0 110.399 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.489 HG13 ' C ' ' B' ' 47' ' ' ALA . 20.0 mt -143.96 168.21 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.398 -0.814 . . . . 0.0 110.102 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -147.46 -179.8 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.11 -0.993 . . . . 0.0 110.254 179.727 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.456 ' O ' ' OG ' ' B' ' 32' ' ' SER . 89.9 m -146.41 156.76 43.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.0 109.852 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.466 HD22 ' CE2' ' B' ' 21' ' ' PHE . 1.6 mt -134.62 125.33 26.96 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.983 -1.073 . . . . 0.0 110.123 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.87 134.31 41.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.283 -0.886 . . . . 0.0 110.482 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.504 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 47.3 m-85 -120.29 155.01 34.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.289 -0.882 . . . . 0.0 110.243 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -86.39 -10.67 53.87 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.235 -0.916 . . . . 0.0 110.521 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.07 150.25 18.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 0.0 110.567 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.406 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 25.9 mt-10 -63.62 -39.14 93.62 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.254 -0.904 . . . . 0.0 109.938 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . 0.476 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 62.2 t-105 -53.6 -52.18 60.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.226 -0.922 . . . . 0.0 109.851 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -57.3 -35.64 70.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.38 -0.825 . . . . 0.0 110.621 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.406 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 22.1 ttp85 -59.68 -50.02 75.49 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.088 -1.008 . . . . 0.0 110.956 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -60.97 -33.36 73.09 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.249 -0.907 . . . . 0.0 110.817 -179.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.476 ' NE2' ' CD1' ' B' ' 57' ' ' TRP . 53.3 mt-30 -65.64 -47.32 75.98 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.085 -1.01 . . . . 0.0 110.368 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.471 ' C ' ' CD1' ' B' ' 62' ' ' PHE . 0.8 OUTLIER -55.67 -43.89 76.76 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 109.971 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 87.0 mt -59.28 -35.56 73.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.298 -0.877 . . . . 0.0 110.474 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.8 t -77.83 -18.65 56.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.24 -0.912 . . . . 0.0 110.315 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . 0.463 ' O ' HG13 ' B' ' 66' ' ' VAL . 7.6 mm-40 -94.65 -9.81 33.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.115 -0.99 . . . . 0.0 110.566 -179.5 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.463 HG13 ' O ' ' B' ' 65' ' ' GLN . 27.6 m -141.89 93.28 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 120.962 -1.086 . . . . 0.0 110.565 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . 0.511 ' O ' ' HG3' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -76.33 113.13 13.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.228 -0.92 . . . . 0.0 110.081 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.577 ' CG2' ' HD2' ' B' ' 69' ' ' PRO . 0.0 OUTLIER -89.56 162.63 35.92 Favored Pre-proline 0 N--CA 1.497 1.891 0 O-C-N 121.153 -0.967 . . . . 0.0 109.611 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.577 ' HD2' ' CG2' ' B' ' 68' ' ' ILE . 46.2 Cg_endo -60.64 -177.25 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.841 1.443 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -93.51 -5.56 48.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.17 -0.956 . . . . 0.0 110.368 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 88.0 m -84.59 -20.38 31.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.193 -0.942 . . . . 0.0 110.002 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.54 ' CG2' ' HG ' ' B' ' 7' ' ' LEU . 36.6 mt -94.67 107.46 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.333 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 88.9 m -95.33 157.28 15.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.394 -0.816 . . . . 0.0 110.881 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.543 HG21 ' CG1' ' B' ' 5' ' ' VAL . 8.2 p -141.96 130.51 22.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 CA-C-O 121.948 0.88 . . . . 0.0 111.188 -178.71 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.78 171.42 7.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.352 0.596 . . . . 0.0 110.554 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 33.4 p -110.29 145.37 37.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.322 -0.862 . . . . 0.0 109.848 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -156.12 176.48 33.55 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -147.87 147.62 29.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.241 -1.152 . . . . 0.0 110.179 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 24.4 mtt -120.91 177.81 4.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.298 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.9 t -140.51 107.15 5.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.917 . . . . 0.0 110.358 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.198 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.247 0.546 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.34 150.89 77.74 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.506 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 46.4 Cg_endo -100.99 145.78 0.31 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.886 1.466 . . . . 0.0 110.313 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.78 167.68 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 110.145 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.1 t -145.91 130.29 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.201 -0.937 . . . . 0.0 110.413 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.526 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.8 m170 -105.98 125.16 50.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 109.959 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.434 ' C ' HD12 ' A' ' 7' ' ' LEU . 1.9 pp -121.92 146.77 46.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.084 -1.01 . . . . 0.0 110.478 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 12.4 ttmm -139.35 161.96 36.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.22 -0.925 . . . . 0.0 110.483 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.45 -165.93 38.13 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -65.05 140.37 58.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -1.217 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.42 -49.81 53.76 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 110.498 -179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -64.54 -43.53 93.7 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.279 -0.888 . . . . 0.0 110.845 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.7 m -57.81 -24.84 59.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.127 -0.983 . . . . 0.0 110.433 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.422 HD21 HD13 ' A' ' 7' ' ' LEU . 46.6 mt -79.75 -30.94 40.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.885 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -59.49 -41.82 90.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.478 -0.764 . . . . 0.0 110.558 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.53 -37.13 76.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.301 -0.874 . . . . 0.0 110.603 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 11.9 mt -59.07 -52.36 66.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.154 -0.967 . . . . 0.0 110.613 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -45.24 -31.39 1.5 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.679 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -64.82 -40.69 95.59 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.246 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -66.91 -35.92 81.08 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.1 m-30 -66.45 -35.38 80.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 110.32 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -63.43 -40.57 97.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.411 ' HA ' ' HD2' ' A' ' 23' ' ' LYS . 3.6 tptt -75.01 -37.85 61.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.0 110.318 -179.825 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.632 ' O ' ' N ' ' A' ' 26' ' ' THR . 90.7 m-70 -95.44 33.75 1.55 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.163 -0.961 . . . . 0.0 110.443 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.564 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 32.0 p -59.36 53.36 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.489 -0.757 . . . . 0.0 111.275 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.632 ' N ' ' O ' ' A' ' 24' ' ' HIS . 14.8 p -144.42 34.63 1.18 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.936 -1.102 . . . . 0.0 109.853 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.43 HD23 ' CG ' ' A' ' 58' ' ' GLN . 10.4 mt -146.77 -21.69 0.42 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.194 -0.941 . . . . 0.0 111.382 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.62 ' CE2' ' CG2' ' A' ' 31' ' ' VAL . 39.8 p90 -115.42 166.64 11.66 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.442 -1.411 . . . . 0.0 109.56 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.85 -32.33 10.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.923 -1.111 . . . . 0.0 111.514 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.435 ' HB2' ' CE3' ' B' ' 37' ' ' TRP . . . -159.45 117.7 2.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.801 -1.187 . . . . 0.0 111.111 -179.442 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.62 ' CG2' ' CE2' ' A' ' 28' ' ' TYR . 5.1 t -89.84 102.16 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 110.025 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.578 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 5.0 p -69.39 147.05 51.54 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.482 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.35 161.1 9.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 110.226 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.401 ' HA ' HG22 ' A' ' 49' ' ' VAL . 3.0 t -68.28 140.79 55.99 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.383 -0.823 . . . . 0.0 110.753 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 63.2 p-90 -146.95 -176.1 5.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.405 -0.809 . . . . 0.0 109.418 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.478 ' HB2' ' HA ' ' A' ' 46' ' ' SER . 2.5 p-80 -162.57 174.32 12.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.89 -1.131 . . . . 0.0 111.047 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.503 ' CE3' ' HB2' ' B' ' 30' ' ' ALA . 57.7 m95 -79.13 118.46 21.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.538 -0.726 . . . . 0.0 110.09 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.0 m -89.1 87.57 7.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.334 -0.854 . . . . 0.0 110.306 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -132.33 162.15 23.97 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -53.2 -62.14 1.85 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.247 -1.149 . . . . 0.0 110.004 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -91.06 90.5 7.87 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.327 -0.858 . . . . 0.0 110.032 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 8.0 p -145.8 17.2 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.0 110.368 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.5 tttp -56.25 -17.71 8.32 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.231 -0.918 . . . . 0.0 109.998 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 62.4 m-70 -54.26 -68.28 0.19 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.83 . . . . 0.0 110.045 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.4 mmtt -122.15 168.84 11.5 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.283 -0.885 . . . . 0.0 110.055 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.478 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 73.3 p -170.14 37.54 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.195 -0.941 . . . . 0.0 110.168 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -167.2 110.16 0.68 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.214 -0.929 . . . . 0.0 110.418 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' TRP . 16.8 mt -142.74 141.85 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.297 -0.877 . . . . 0.0 109.958 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.407 HG13 ' O ' ' A' ' 32' ' ' SER . 91.7 t -124.37 122.75 64.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.083 -1.011 . . . . 0.0 110.427 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.5 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 20.7 m -94.37 157.32 16.08 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.289 -0.882 . . . . 0.0 110.116 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 1.2 mt -135.32 130.98 35.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.254 -0.904 . . . . 0.0 110.198 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 63.4 p -96.76 127.29 42.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.237 -0.914 . . . . 0.0 110.464 -179.744 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.556 ' OH ' ' CE2' ' A' ' 62' ' ' PHE . 27.4 m-85 -103.78 146.39 28.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 110.026 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 -9.68 55.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.175 -0.953 . . . . 0.0 110.769 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.9 p -162.62 134.98 5.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.068 -1.02 . . . . 0.0 110.591 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.93 -40.16 60.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.292 -0.88 . . . . 0.0 109.848 179.64 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 4.7 t-105 -53.55 -55.27 27.04 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.441 -0.787 . . . . 0.0 109.995 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' A' ' 61' ' ' GLN . 16.3 tt0 -57.03 -35.37 69.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.332 -0.855 . . . . 0.0 110.39 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.465 ' O ' ' HB3' ' A' ' 62' ' ' PHE . 7.3 ttp85 -59.52 -33.48 71.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.096 -1.003 . . . . 0.0 109.992 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.45 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -61.53 -60.8 3.14 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.359 -0.838 . . . . 0.0 111.305 -179.501 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.524 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 4.1 pm0 -65.14 -18.85 65.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.006 -1.059 . . . . 0.0 110.758 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.556 ' CE2' ' OH ' ' A' ' 53' ' ' TYR . 38.4 t80 -57.25 -65.01 0.7 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.009 -1.057 . . . . 0.0 110.401 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.467 ' HA ' HG23 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -59.51 -39.86 85.2 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.478 -0.764 . . . . 0.0 111.312 -179.235 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.51 -22.03 66.68 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.907 -1.121 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.524 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 15.6 mm-40 -95.37 -30.54 13.86 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.344 -0.848 . . . . 0.0 109.967 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.544 ' CG2' ' O ' ' A' ' 66' ' ' VAL . 15.1 m -97.91 85.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.302 -0.874 . . . . 0.0 109.72 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.47 ' C ' ' O ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -38.44 105.77 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.342 -0.849 . . . . 0.0 110.441 -179.639 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.499 ' O ' ' CG2' ' A' ' 68' ' ' ILE . 10.9 tt -89.53 126.67 57.4 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.532 -0.73 . . . . 0.0 110.17 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.08 -177.81 1.48 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.926 1.487 . . . . 0.0 110.396 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -86.64 -12.79 47.47 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.216 -0.928 . . . . 0.0 110.226 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.74 -11.21 56.28 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 110.165 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.412 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 9.8 mm -94.37 121.33 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.16 -0.962 . . . . 0.0 109.96 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.3 m -95.23 136.09 36.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.05 -1.031 . . . . 0.0 109.818 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.2 t -88.75 156.97 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.055 -1.028 . . . . 0.0 110.871 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.526 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 1.2 m -142.73 154.83 44.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.833 -0.542 . . . . 0.0 110.341 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.412 ' O ' HD12 ' B' ' 81' ' ' ILE . 21.1 p -133.0 134.98 45.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.075 179.484 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.6 -175.57 30.71 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -148.1 152.78 37.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.206 -1.173 . . . . 0.0 110.528 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -123.74 169.69 11.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.334 -0.854 . . . . 0.0 109.949 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.435 ' O ' HD12 ' A' ' 81' ' ' ILE . 9.6 t -150.22 99.65 2.82 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.244 -0.91 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.462 HD12 ' O ' ' B' ' 76' ' ' THR . 1.1 mp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.051 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.306 0.574 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.2 150.45 76.54 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.25 -0.906 . . . . 0.0 110.094 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.516 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.2 Cg_endo -100.19 145.59 0.38 Allowed 'Trans proline' 0 C--N 1.304 -1.791 0 O-C-N 123.94 1.494 . . . . 0.0 110.187 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.72 168.09 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.02 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -146.12 130.35 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.93 . . . . 0.0 110.426 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.569 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.7 m170 -106.09 125.64 51.23 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.297 -0.877 . . . . 0.0 109.782 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.448 HD13 HD21 ' B' ' 14' ' ' LEU . 1.9 pp -122.76 147.26 46.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.987 -1.071 . . . . 0.0 110.536 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.427 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 12.4 ttmm -139.61 162.03 36.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.288 -0.882 . . . . 0.0 110.465 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.84 -166.38 38.57 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -64.93 140.18 58.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -1.172 . . . . 0.0 110.252 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.97 -49.56 49.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -65.0 -43.52 92.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.828 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 75.5 m -57.64 -24.28 55.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.184 -0.948 . . . . 0.0 110.504 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.448 HD21 HD13 ' B' ' 7' ' ' LEU . 41.7 mt -80.82 -30.64 35.78 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.155 -0.966 . . . . 0.0 109.918 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -59.42 -41.91 90.6 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.406 -0.808 . . . . 0.0 110.45 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -69.78 -37.27 76.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.369 -0.832 . . . . 0.0 110.605 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 mt -58.82 -51.55 69.54 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.033 -1.042 . . . . 0.0 110.297 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.5 ttp85 -45.49 -31.69 1.88 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.291 -0.88 . . . . 0.0 110.582 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -64.78 -40.6 95.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.109 -0.994 . . . . 0.0 110.239 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -67.15 -35.76 80.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.145 -0.972 . . . . 0.0 110.156 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.427 ' N ' ' CD1' ' B' ' 21' ' ' PHE . 10.1 m-30 -66.43 -35.11 79.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -63.51 -40.87 98.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.313 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . 0.408 ' HA ' ' HD2' ' B' ' 23' ' ' LYS . 3.6 tptt -75.02 -38.03 61.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.165 -0.96 . . . . 0.0 110.452 -179.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.633 ' O ' ' N ' ' B' ' 26' ' ' THR . 91.3 m-70 -95.25 33.8 1.51 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.202 -0.936 . . . . 0.0 110.348 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.584 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 32.0 p -59.34 53.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.536 -0.727 . . . . 0.0 111.318 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.633 ' N ' ' O ' ' B' ' 24' ' ' HIS . 9.3 p -144.38 34.73 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.908 -1.12 . . . . 0.0 109.822 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.426 ' O ' ' CD ' ' B' ' 58' ' ' GLN . 10.9 mt -146.9 -21.47 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.181 -0.949 . . . . 0.0 111.356 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.593 ' CE2' ' CG2' ' B' ' 31' ' ' VAL . 39.5 p90 -115.45 166.73 11.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.604 -1.31 . . . . 0.0 109.558 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -32.6 10.57 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.941 -1.099 . . . . 0.0 111.583 -179.13 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.503 ' HB2' ' CE3' ' A' ' 37' ' ' TRP . . . -159.58 118.07 2.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.816 -1.177 . . . . 0.0 111.08 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.593 ' CG2' ' CE2' ' B' ' 28' ' ' TYR . 4.6 t -89.91 101.08 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.361 -0.837 . . . . 0.0 110.086 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.58 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 5.5 p -67.85 146.78 53.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.075 -1.016 . . . . 0.0 110.438 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.38 161.6 9.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.221 -0.925 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.451 ' HA ' HG22 ' B' ' 49' ' ' VAL . 3.5 t -68.27 140.38 55.99 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.3 -0.875 . . . . 0.0 110.628 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.578 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 62.8 p-90 -147.03 -176.43 5.21 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.369 -0.832 . . . . 0.0 109.542 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.472 ' HB2' ' HA ' ' B' ' 46' ' ' SER . 2.6 p-80 -162.44 174.4 12.77 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.839 -1.163 . . . . 0.0 111.121 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.435 ' CE3' ' HB2' ' A' ' 30' ' ' ALA . 56.8 m95 -79.21 118.34 21.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.447 -0.783 . . . . 0.0 110.183 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 20.4 m -89.1 88.3 7.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.322 -0.861 . . . . 0.0 110.248 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.28 161.71 24.22 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -52.67 -62.71 1.47 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.283 -1.128 . . . . 0.0 110.072 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -90.64 91.12 8.27 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.086 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 8.9 p -146.04 15.23 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.235 -0.916 . . . . 0.0 110.194 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 36.7 tttp -54.42 -17.9 3.6 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.229 -0.919 . . . . 0.0 110.052 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 60.1 m-70 -54.51 -67.9 0.23 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.283 -0.886 . . . . 0.0 110.215 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 39.0 mmtt -122.55 166.57 14.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.27 -0.894 . . . . 0.0 110.248 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.472 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . 75.0 p -167.65 35.87 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.274 -0.891 . . . . 0.0 110.484 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -165.68 110.72 0.86 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.097 -1.002 . . . . 0.0 110.504 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 35' ' ' TRP . 15.9 mt -142.61 142.05 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.415 -0.803 . . . . 0.0 109.996 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . 0.451 HG22 ' HA ' ' B' ' 34' ' ' THR . 88.9 t -124.47 121.91 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.069 -1.019 . . . . 0.0 110.209 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.569 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 18.1 m -93.8 157.7 16.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.933 . . . . 0.0 109.953 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 1.2 mt -135.26 131.53 36.7 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.114 -0.991 . . . . 0.0 110.266 -179.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.431 HG23 ' CH2' ' A' ' 37' ' ' TRP . 56.6 p -97.06 127.52 43.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.372 -0.83 . . . . 0.0 110.51 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.52 ' OH ' ' CE2' ' B' ' 62' ' ' PHE . 28.7 m-85 -104.32 146.43 28.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.892 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.63 -8.65 57.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 110.805 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 73.1 p -163.83 135.21 4.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.067 -1.02 . . . . 0.0 110.585 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.95 -40.27 60.59 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.86 . . . . 0.0 109.961 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -53.42 -54.99 28.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.333 -0.854 . . . . 0.0 109.894 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.475 ' O ' ' HG2' ' B' ' 61' ' ' GLN . 17.4 tt0 -57.02 -36.0 69.93 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.386 -0.821 . . . . 0.0 110.455 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.45 ' O ' ' HB3' ' B' ' 62' ' ' PHE . 6.4 ttp180 -59.54 -33.17 71.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.971 -1.081 . . . . 0.0 110.128 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.432 ' O ' ' HG ' ' B' ' 63' ' ' LEU . 0.3 OUTLIER -61.48 -60.81 3.14 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.394 -0.816 . . . . 0.0 111.205 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.526 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 4.2 pm0 -65.17 -19.14 65.83 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.902 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.52 ' CE2' ' OH ' ' B' ' 53' ' ' TYR . 36.2 t80 -57.02 -65.35 0.63 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.055 -1.028 . . . . 0.0 110.36 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.484 ' HA ' HG23 ' B' ' 66' ' ' VAL . 0.4 OUTLIER -59.36 -39.37 83.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.452 -0.78 . . . . 0.0 111.305 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.87 -21.82 66.49 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.859 -1.151 . . . . 0.0 110.292 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 15.4 mm-40 -95.42 -30.95 13.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.896 . . . . 0.0 109.985 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.536 ' CG2' ' O ' ' B' ' 66' ' ' VAL . 16.6 m -97.42 85.49 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 109.895 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . 0.466 ' C ' ' O ' ' B' ' 66' ' ' VAL . 0.1 OUTLIER -37.84 105.92 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.421 -0.8 . . . . 0.0 110.56 -179.711 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.496 ' CG2' ' O ' ' B' ' 68' ' ' ILE . 10.3 tt -89.89 126.7 56.62 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.359 -0.838 . . . . 0.0 110.182 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -67.93 -177.88 1.46 Allowed 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 124.018 1.536 . . . . 0.0 110.32 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -86.74 -12.85 47.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.248 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -11.58 55.42 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 110.216 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.427 ' HA ' ' O ' ' B' ' 8' ' ' LYS . 9.8 mm -94.3 121.41 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.217 -0.927 . . . . 0.0 109.898 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.0 m -95.41 136.35 35.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.018 -1.052 . . . . 0.0 109.937 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 11.1 t -88.55 156.92 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.029 -1.045 . . . . 0.0 111.074 -178.287 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' SER . . . . . 0.528 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 1.4 m -142.52 154.76 44.77 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.75 -0.594 . . . . 0.0 110.402 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' THR . . . . . 0.462 ' O ' HD12 ' A' ' 81' ' ' ILE . 21.0 p -133.1 134.68 44.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.175 -0.953 . . . . 0.0 110.103 179.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.51 -175.62 30.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -147.88 153.01 38.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.177 -1.19 . . . . 0.0 110.509 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -124.12 168.6 12.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.272 -0.892 . . . . 0.0 110.039 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.445 ' O ' HD12 ' B' ' 81' ' ' ILE . 9.2 t -149.08 99.87 3.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.145 -0.972 . . . . 0.0 110.417 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.445 HD12 ' O ' ' B' ' 80' ' ' SER . 1.1 mp . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 118.035 -0.984 . . . . 0.0 109.969 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.444 ' CG ' ' O ' ' A' ' 79' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.246 0.546 . . . . 0.0 110.152 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -146.39 170.89 7.13 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.212 -0.93 . . . . 0.0 110.303 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.502 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 51.9 Cg_endo -104.61 145.6 0.13 Allowed 'Trans proline' 0 C--N 1.307 -1.638 0 O-C-N 124.034 1.544 . . . . 0.0 110.308 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.462 HG22 ' O ' ' A' ' 3' ' ' PRO . 2.8 pt -143.82 162.63 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.212 -0.93 . . . . 0.0 110.041 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.521 ' CG2' HG23 ' A' ' 74' ' ' VAL . 9.6 p -145.78 127.47 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 0.0 110.074 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.593 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.1 m170 -104.13 118.32 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.348 -0.845 . . . . 0.0 110.135 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.423 ' CD2' ' O ' ' A' ' 49' ' ' VAL . 1.3 pp -111.54 150.91 29.31 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.127 -0.983 . . . . 0.0 110.222 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.527 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 7.6 tptm -138.71 159.27 42.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 110.482 -179.132 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.527 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 170.67 -174.56 44.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.474 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 40.2 m-20 -65.05 141.49 58.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.153 -1.204 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.497 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.33 -69.28 0.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.238 -0.914 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -47.78 -44.96 28.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.065 -1.022 . . . . 0.0 110.385 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.474 ' HB ' ' HB2' ' A' ' 10' ' ' ASP . 41.4 m -58.22 -22.81 53.55 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.257 -0.902 . . . . 0.0 110.61 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.497 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 62.8 mt -78.39 -29.79 47.46 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.179 -0.951 . . . . 0.0 110.532 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -59.71 -34.44 72.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.211 -0.931 . . . . 0.0 110.417 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.483 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.9 t -70.27 -46.13 64.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.358 -0.839 . . . . 0.0 110.943 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.8 mp -58.82 -52.76 64.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.057 -1.027 . . . . 0.0 110.59 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.411 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 10.5 ttm180 -45.04 -24.69 0.25 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.221 -0.924 . . . . 0.0 110.516 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.483 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 40.1 t80 -64.8 -40.46 95.26 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.078 -1.014 . . . . 0.0 110.234 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -72.88 -21.18 60.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 110.134 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.411 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 8.6 m-30 -66.26 -31.32 72.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 109.954 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -63.57 -33.98 76.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.338 -0.851 . . . . 0.0 110.336 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -75.08 -35.15 61.82 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.245 -0.909 . . . . 0.0 110.41 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 73.4 m-70 -94.48 40.93 1.09 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.243 -0.91 . . . . 0.0 110.12 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.443 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 27.3 p -57.65 -21.52 40.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.355 -0.841 . . . . 0.0 110.512 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.412 HG23 ' SG ' ' A' ' 25' ' ' CYS . 69.2 p -96.52 10.91 36.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.095 -1.003 . . . . 0.0 110.499 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.499 ' HB2' ' HB3' ' A' ' 24' ' ' HIS . 2.3 mt -92.26 -49.39 6.2 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 110.16 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.443 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 4.4 p90 -98.9 168.56 10.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.247 -0.908 . . . . 0.0 110.236 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.1 m -98.92 -31.35 11.87 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.848 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.08 116.09 2.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.011 -1.056 . . . . 0.0 110.608 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 11.2 p -90.2 135.06 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.883 179.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.486 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -108.37 154.25 22.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.083 -1.011 . . . . 0.0 110.689 -179.689 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.35 162.56 7.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.359 -0.838 . . . . 0.0 110.265 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.455 ' O ' HG21 ' A' ' 34' ' ' THR . 2.2 t -68.14 131.06 44.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.26 -0.9 . . . . 0.0 110.751 -179.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.536 ' HB3' ' CB ' ' B' ' 35' ' ' TRP . 3.9 p-90 -146.93 157.51 43.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.353 -0.842 . . . . 0.0 109.405 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.486 ' CG ' ' HB3' ' A' ' 46' ' ' SER . 5.3 p80 -162.58 -173.73 3.67 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.823 -1.173 . . . . 0.0 111.354 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.6 m95 -79.97 138.82 37.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.66 -0.65 . . . . 0.0 110.114 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.46 31.17 6.58 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 110.408 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -83.5 -128.54 1.44 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 11.9 p-80 -112.82 -1.95 14.51 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.246 -1.15 . . . . 0.0 110.027 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.442 ' O ' HG12 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -85.33 45.46 1.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.85 . . . . 0.0 110.377 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.442 HG12 ' O ' ' A' ' 41' ' ' ASN . 28.3 m -149.13 119.27 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.326 -0.859 . . . . 0.0 110.065 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -47.12 -49.66 21.64 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.894 . . . . 0.0 110.21 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.472 ' O ' ' NZ ' ' A' ' 45' ' ' LYS . 23.0 t-160 -140.38 -72.76 0.36 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.205 -0.935 . . . . 0.0 110.061 -179.86 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.472 ' NZ ' ' O ' ' A' ' 44' ' ' HIS . 12.6 mmtm -131.47 -155.53 0.7 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.252 -0.905 . . . . 0.0 109.761 179.574 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.486 ' HB3' ' CG ' ' A' ' 36' ' ' HIS . 40.6 t -171.77 -179.4 2.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.966 -1.084 . . . . 0.0 110.471 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.471 ' HB1' ' CD1' ' A' ' 14' ' ' LEU . . . -173.73 118.75 0.28 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.333 -0.855 . . . . 0.0 109.968 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.472 HG12 ' HB2' ' A' ' 8' ' ' LYS . 74.1 mt -145.03 133.76 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.326 -0.859 . . . . 0.0 110.123 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.423 ' O ' ' CD2' ' A' ' 7' ' ' LEU . 19.1 t -119.73 130.27 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.049 -1.032 . . . . 0.0 110.442 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.58 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 3.0 m -94.16 156.41 16.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.336 -0.853 . . . . 0.0 110.234 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.493 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 1.0 OUTLIER -135.01 129.98 34.97 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.245 -0.909 . . . . 0.0 109.637 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.11 130.94 44.32 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.217 -0.927 . . . . 0.0 110.675 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.502 ' O ' ' HG2' ' A' ' 3' ' ' PRO . 49.0 m-85 -118.48 155.79 30.21 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.383 -0.823 . . . . 0.0 109.956 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.69 -10.32 59.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 110.32 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.9 p -170.26 166.19 8.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.168 -0.958 . . . . 0.0 110.305 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.44 -34.96 73.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.344 -0.848 . . . . 0.0 110.171 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -53.79 -50.82 65.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.342 -0.848 . . . . 0.0 110.12 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -57.95 -38.04 75.25 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.251 -0.906 . . . . 0.0 110.855 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.18 -44.31 92.17 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.003 -1.06 . . . . 0.0 110.745 -179.892 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 46.7 t0 -61.01 -38.58 86.6 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.104 -0.998 . . . . 0.0 110.518 -179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -65.92 -41.49 91.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.134 -0.979 . . . . 0.0 110.725 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.579 ' CE1' HG23 ' A' ' 66' ' ' VAL . 2.7 t80 -55.85 -47.4 77.35 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 13.5 mt -59.44 -44.66 92.9 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.256 -0.903 . . . . 0.0 110.459 -179.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -21.45 66.54 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.254 -0.904 . . . . 0.0 110.63 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -95.44 -25.26 16.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.085 -1.01 . . . . 0.0 110.369 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.579 HG23 ' CE1' ' A' ' 62' ' ' PHE . 31.2 m -103.64 105.06 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.892 . . . . 0.0 110.036 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -51.4 97.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.192 -0.943 . . . . 0.0 110.395 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.566 ' O ' ' CG2' ' A' ' 68' ' ' ILE . 9.4 tp -88.66 117.5 68.39 Favored Pre-proline 0 N--CA 1.487 1.424 0 O-C-N 121.169 -0.957 . . . . 0.0 109.979 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.494 ' CG ' HD11 ' A' ' 72' ' ' ILE . 46.2 Cg_endo -60.58 167.97 7.45 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.916 1.482 . . . . 0.0 110.852 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -79.53 -12.98 59.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.45 -0.782 . . . . 0.0 110.315 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.61 -23.73 29.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.27 -0.894 . . . . 0.0 110.227 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.494 HD11 ' CG ' ' A' ' 69' ' ' PRO . 66.0 mt -93.68 115.27 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.913 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.3 m -95.09 142.48 27.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.323 -0.861 . . . . 0.0 110.727 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.521 HG23 ' CG2' ' A' ' 5' ' ' VAL . 6.0 p -92.25 178.49 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.421 -0.799 . . . . 0.0 110.582 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.593 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.6 OUTLIER -143.85 158.76 43.47 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.499 179.216 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.6 p -133.86 135.12 43.5 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.231 -0.918 . . . . 0.0 110.058 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -160.74 177.03 37.31 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.431 ' CD2' ' HB3' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.93 120.43 8.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.287 -1.125 . . . . 0.0 109.969 -179.802 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.452 ' SD ' HD13 ' B' ' 4' ' ' ILE . 18.3 mmm -95.13 171.74 8.55 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.051 -1.031 . . . . 0.0 110.576 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 86.3 p -153.67 107.81 3.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.33 -0.856 . . . . 0.0 110.305 179.87 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.6 pt . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.225 179.961 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.487 ' CG ' ' O ' ' B' ' 79' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.198 0.523 . . . . 0.0 110.11 . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.5 t -146.13 171.96 5.84 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.262 -0.899 . . . . 0.0 110.103 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.486 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 51.1 Cg_endo -106.13 145.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.847 1.446 . . . . 0.0 110.054 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.465 HG22 ' O ' ' B' ' 3' ' ' PRO . 2.7 pt -143.83 162.79 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.253 -0.904 . . . . 0.0 110.04 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.504 ' CG2' HG23 ' B' ' 74' ' ' VAL . 8.6 p -145.67 127.84 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.336 -0.853 . . . . 0.0 110.08 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.595 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 1.5 m170 -104.66 118.19 35.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.355 -0.841 . . . . 0.0 110.148 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.441 HD21 ' O ' ' B' ' 49' ' ' VAL . 1.3 pp -111.35 150.93 29.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 110.219 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.53 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 7.7 tptm -138.56 159.53 41.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 110.381 -179.13 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.53 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 170.23 -174.55 44.3 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . 0.479 ' HB2' ' HB ' ' B' ' 13' ' ' THR . 40.6 m-20 -65.12 141.83 58.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.126 -1.22 . . . . 0.0 110.291 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.495 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.37 -69.4 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.315 -0.865 . . . . 0.0 110.524 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -47.54 -45.49 26.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.156 -0.965 . . . . 0.0 110.528 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.479 ' HB ' ' HB2' ' B' ' 10' ' ' ASP . 37.2 m -58.14 -22.09 49.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 110.723 -179.677 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.495 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 65.2 mt -78.83 -29.69 44.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.141 -0.975 . . . . 0.0 110.487 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -59.82 -34.4 73.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.213 -0.929 . . . . 0.0 110.319 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.485 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 1.6 t -70.31 -46.49 64.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.215 -0.928 . . . . 0.0 110.966 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.64 -52.81 64.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.066 -1.021 . . . . 0.0 110.536 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -45.09 -24.74 0.26 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 110.621 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.485 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 41.5 t80 -64.8 -39.7 94.02 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.216 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -73.41 -21.29 60.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.145 -0.972 . . . . 0.0 110.159 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -66.18 -31.43 72.26 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.228 -0.92 . . . . 0.0 109.897 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -63.49 -33.76 76.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.12 -35.16 61.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.175 -0.953 . . . . 0.0 110.436 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.49 ' HB3' ' HB2' ' B' ' 27' ' ' LEU . 76.0 m-70 -94.84 41.16 1.09 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.942 . . . . 0.0 110.169 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.451 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 27.5 p -57.32 -21.07 32.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.359 -0.838 . . . . 0.0 110.379 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.449 HG23 ' SG ' ' B' ' 25' ' ' CYS . 69.8 p -96.91 10.63 38.51 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.128 -0.982 . . . . 0.0 110.467 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.49 ' HB2' ' HB3' ' B' ' 24' ' ' HIS . 2.6 mt -92.23 -49.18 6.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.19 -0.944 . . . . 0.0 110.286 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.451 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 4.3 p90 -98.92 168.45 10.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.5 m -98.78 -31.12 12.04 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.25 -0.906 . . . . 0.0 110.68 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.29 116.44 2.7 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.011 -1.056 . . . . 0.0 110.594 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 11.2 p -90.27 135.14 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.304 -0.873 . . . . 0.0 109.663 179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.477 ' CB ' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -108.2 154.66 21.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.114 -0.991 . . . . 0.0 110.615 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.39 162.44 7.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.43 -0.794 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.445 HG21 ' O ' ' B' ' 34' ' ' THR . 2.1 t -68.24 130.51 43.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.266 -0.896 . . . . 0.0 110.64 -179.948 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.536 ' CB ' ' HB3' ' A' ' 35' ' ' TRP . 4.3 p-90 -146.83 157.33 43.63 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.287 -0.883 . . . . 0.0 109.368 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.479 ' CG ' ' HB3' ' B' ' 46' ' ' SER . 6.2 p80 -162.45 -173.68 3.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.866 -1.146 . . . . 0.0 111.359 -179.533 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -79.89 139.94 36.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.686 -0.634 . . . . 0.0 109.995 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.54 30.58 6.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.199 -0.938 . . . . 0.0 110.322 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -82.99 -128.77 1.31 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.344 -1.502 . . . . 0.0 109.344 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 11.4 p-80 -112.58 -1.05 14.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.22 -1.165 . . . . 0.0 109.988 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . 0.47 ' O ' HG12 ' B' ' 42' ' ' VAL . 0.2 OUTLIER -86.43 46.3 1.33 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.349 -0.844 . . . . 0.0 110.2 179.993 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.47 HG12 ' O ' ' B' ' 41' ' ' ASN . 28.2 m -149.92 118.55 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.266 -0.896 . . . . 0.0 110.051 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -46.84 -49.94 19.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.308 -0.87 . . . . 0.0 110.116 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . 0.462 ' O ' ' NZ ' ' B' ' 45' ' ' LYS . 22.9 t-160 -139.71 -72.11 0.38 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.214 -0.929 . . . . 0.0 110.114 -179.921 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . 0.462 ' NZ ' ' O ' ' B' ' 44' ' ' HIS . 12.9 mmtm -132.56 -155.0 0.65 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.265 -0.897 . . . . 0.0 109.84 179.863 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.479 ' HB3' ' CG ' ' B' ' 36' ' ' HIS . 43.4 t -172.73 -179.1 2.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.939 -1.101 . . . . 0.0 110.684 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.441 ' HB1' ' CD1' ' B' ' 14' ' ' LEU . . . -174.27 118.92 0.24 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.31 -0.869 . . . . 0.0 110.176 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.479 HG12 ' HB2' ' B' ' 8' ' ' LYS . 74.7 mt -144.98 133.32 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 109.967 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . 0.441 ' O ' HD21 ' B' ' 7' ' ' LEU . 16.5 t -119.2 130.37 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.038 -1.039 . . . . 0.0 110.424 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.578 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 2.7 m -94.07 157.1 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.308 -0.87 . . . . 0.0 110.27 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.492 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 1.0 OUTLIER -135.51 129.84 33.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 179.614 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.13 131.01 44.31 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.154 -0.966 . . . . 0.0 110.711 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.486 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 44.0 m-85 -118.65 155.44 31.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 0.0 110.085 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -70.8 -10.1 58.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.156 -0.965 . . . . 0.0 110.488 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 40.7 p -170.1 166.17 9.13 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.209 -0.932 . . . . 0.0 110.269 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -70.59 -35.1 72.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.182 -0.948 . . . . 0.0 110.236 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.47 -51.04 64.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.403 -0.811 . . . . 0.0 110.224 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -58.02 -37.18 73.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 110.734 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -59.55 -44.71 93.18 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.085 -1.01 . . . . 0.0 110.631 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 48.0 t0 -60.94 -38.41 85.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.197 -0.94 . . . . 0.0 110.624 -179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -65.8 -41.44 91.93 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.268 -0.895 . . . . 0.0 110.747 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.572 ' CE1' HG23 ' B' ' 66' ' ' VAL . 2.3 t80 -55.96 -47.41 77.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.156 -0.965 . . . . 0.0 110.24 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 13.7 mt -59.48 -43.95 93.14 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.166 -0.959 . . . . 0.0 110.652 -179.658 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -21.33 66.23 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.204 -0.935 . . . . 0.0 110.628 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.31 -25.27 16.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.157 -0.964 . . . . 0.0 110.296 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.572 HG23 ' CE1' ' B' ' 62' ' ' PHE . 32.4 m -103.78 104.81 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.3 -0.875 . . . . 0.0 109.952 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttt -51.34 97.59 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.319 -0.863 . . . . 0.0 110.379 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.563 ' CG2' ' O ' ' B' ' 68' ' ' ILE . 8.6 tp -88.43 117.77 68.73 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.259 -0.9 . . . . 0.0 109.932 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.526 ' CG ' HD11 ' B' ' 72' ' ' ILE . 48.7 Cg_endo -61.23 168.25 8.03 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.889 1.468 . . . . 0.0 110.594 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -79.98 -12.81 59.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.283 -0.886 . . . . 0.0 110.347 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.53 -23.08 29.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.224 -0.923 . . . . 0.0 110.09 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.526 HD11 ' CG ' ' B' ' 69' ' ' PRO . 67.5 mt -94.21 115.29 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.253 -0.905 . . . . 0.0 110.026 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 7.7 m -95.23 142.38 27.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.33 -0.856 . . . . 0.0 110.839 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.504 HG23 ' CG2' ' B' ' 5' ' ' VAL . 5.4 p -92.28 178.65 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.278 -0.889 . . . . 0.0 110.52 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' SER . . . . . 0.595 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -144.03 158.64 43.58 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.397 -0.814 . . . . 0.0 110.622 179.125 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.9 p -133.57 134.72 43.67 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 110.129 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.94 176.83 36.62 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.405 ' CD2' ' HB3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -148.06 119.94 8.16 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.316 -1.108 . . . . 0.0 109.82 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.487 ' O ' ' CG ' ' B' ' 1' ' ' MET . 19.1 mmm -94.52 173.08 7.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.971 -1.081 . . . . 0.0 110.472 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 85.9 p -154.85 107.16 2.73 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.222 -0.924 . . . . 0.0 110.272 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 4.8 pt . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 117.921 -1.038 . . . . 0.0 110.262 -179.972 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.205 0.526 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.5 m -68.61 121.65 81.77 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 121.263 -0.898 . . . . 0.0 110.122 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.498 ' O ' HG22 ' A' ' 4' ' ' ILE . 47.1 Cg_endo -69.11 157.17 62.68 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.08 1.568 . . . . 0.0 110.52 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.498 HG22 ' O ' ' A' ' 3' ' ' PRO . 5.1 pt -143.02 169.13 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.231 -0.918 . . . . 0.0 110.031 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.537 ' CG1' HG22 ' A' ' 74' ' ' VAL . 6.4 t -145.8 125.64 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.211 -0.931 . . . . 0.0 110.187 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.465 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -106.19 119.02 38.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.347 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.451 ' O ' HG21 ' A' ' 48' ' ' ILE . 1.4 mp -116.5 147.4 41.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.312 -0.867 . . . . 0.0 110.177 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.52 ' O ' ' CD1' ' A' ' 72' ' ' ILE . 11.5 tttt -142.42 168.5 19.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.214 -0.929 . . . . 0.0 110.388 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.432 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 151.76 -166.02 30.73 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.472 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 131.01 45.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.194 -1.18 . . . . 0.0 110.253 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.97 -39.8 41.98 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.28 -0.887 . . . . 0.0 110.726 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -66.08 -46.91 76.02 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.077 -1.015 . . . . 0.0 110.605 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.8 m -58.1 -27.77 64.0 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.938 . . . . 0.0 110.367 -179.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.509 ' CD2' HD11 ' A' ' 72' ' ' ILE . 77.7 mt -77.71 -27.4 50.65 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.969 . . . . 0.0 110.34 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.2 ttmt -59.35 -39.39 83.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.252 -0.905 . . . . 0.0 110.411 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.473 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.2 t -70.19 -34.23 72.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.098 -1.001 . . . . 0.0 110.423 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.486 HD13 ' N ' ' A' ' 17' ' ' LEU . 5.9 mp -58.94 -51.91 68.01 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.212 -0.93 . . . . 0.0 110.558 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.495 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 1.2 ttp-105 -46.22 -31.86 2.7 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.264 -0.897 . . . . 0.0 110.124 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.473 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 48.4 t80 -65.14 -33.06 75.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.306 -0.871 . . . . 0.0 110.391 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 -74.74 -30.32 61.46 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.203 -0.936 . . . . 0.0 110.465 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.495 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 11.1 m-30 -66.32 -21.58 66.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.461 ' HE2' ' CB ' ' B' ' 40' ' ' HIS . 29.4 mmtp -63.38 -36.53 84.02 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.615 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -75.1 -40.95 59.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -0.936 . . . . 0.0 110.463 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.411 ' HB3' ' HB2' ' A' ' 27' ' ' LEU . 15.0 m-70 -95.12 36.52 1.21 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.227 -0.921 . . . . 0.0 110.328 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.579 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 32.0 p -57.44 -17.92 15.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.474 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.95 -3.29 41.99 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.206 -0.934 . . . . 0.0 110.518 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.411 ' HB2' ' HB3' ' A' ' 24' ' ' HIS . 11.2 mt -92.42 -6.19 50.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.181 -0.949 . . . . 0.0 110.495 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.579 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 22.7 p90 -144.58 -178.08 5.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.194 -0.941 . . . . 0.0 109.528 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 45.6 m -96.47 -68.99 0.77 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.914 -1.116 . . . . 0.0 110.584 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.2 20.79 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.081 -1.012 . . . . 0.0 109.012 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.451 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 12.7 p -91.29 112.58 25.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 O-C-N 121.681 -0.637 . . . . 0.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.433 ' OG ' ' HB ' ' A' ' 50' ' ' THR . 79.5 p -52.59 152.62 3.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.926 -1.109 . . . . 0.0 109.373 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.404 ' OG ' ' HB2' ' B' ' 35' ' ' TRP . 0.8 OUTLIER -60.93 155.08 20.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.166 -0.959 . . . . 0.0 110.305 -179.651 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -67.64 129.78 40.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.333 -0.855 . . . . 0.0 110.318 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.472 ' HB2' ' OG ' ' B' ' 33' ' ' SER . 44.4 p-90 -146.15 176.15 9.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.189 -0.944 . . . . 0.0 109.921 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.471 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 53.2 t-80 -162.57 177.83 9.09 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 110.351 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.471 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 80.2 m95 -78.51 123.99 27.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.225 -0.922 . . . . 0.0 110.126 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.443 ' OG1' ' O ' ' A' ' 37' ' ' TRP . 1.8 m -171.31 159.67 5.84 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.37 -0.831 . . . . 0.0 109.916 -179.799 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -132.21 -125.98 2.69 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 29.9 t-80 -91.2 -40.08 11.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.242 -1.152 . . . . 0.0 110.171 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -135.27 67.02 1.5 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.349 -0.844 . . . . 0.0 110.22 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.427 HG13 ' N ' ' A' ' 43' ' ' LYS . 41.1 t -121.53 171.46 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.284 -0.885 . . . . 0.0 110.196 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.427 ' N ' HG13 ' A' ' 42' ' ' VAL . 36.1 mtpt -94.66 177.63 5.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.303 -0.873 . . . . 0.0 110.197 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 53.6 t60 -115.53 136.18 53.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.271 -0.893 . . . . 0.0 109.893 179.73 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.23 -70.42 0.81 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.19 -0.944 . . . . 0.0 110.533 -179.705 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.476 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.3 OUTLIER -154.16 106.2 2.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.221 -0.925 . . . . 0.0 110.389 -179.845 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.472 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -40.54 157.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.42 -0.8 . . . . 0.0 110.068 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.476 HG13 ' O ' ' A' ' 46' ' ' SER . 70.3 mt -142.07 144.56 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 110.353 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 67.5 t -116.79 169.07 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.285 -0.884 . . . . 0.0 110.458 -179.8 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.433 ' HB ' ' OG ' ' A' ' 32' ' ' SER . 17.4 m -146.05 152.16 38.89 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.369 -0.832 . . . . 0.0 109.891 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.42 128.78 32.17 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.169 -0.957 . . . . 0.0 110.249 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.47 ' OG1' ' CZ3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.61 40.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.361 -0.837 . . . . 0.0 110.158 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.577 ' CD2' ' HA ' ' A' ' 59' ' ' ARG . 40.2 m-85 -111.91 147.35 36.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.203 -0.936 . . . . 0.0 109.93 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -93.21 -3.28 54.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 110.941 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.1 p -157.66 121.04 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.028 -1.045 . . . . 0.0 110.328 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.471 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 2.3 mt-10 -46.32 -42.44 14.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.867 . . . . 0.0 110.132 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.413 ' CD1' ' NE2' ' A' ' 61' ' ' GLN . 16.0 t-105 -53.66 -56.0 21.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -59.07 -31.21 68.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.291 -0.881 . . . . 0.0 110.629 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.577 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -59.34 -54.55 45.43 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.273 -0.892 . . . . 0.0 111.061 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.0 -31.7 71.3 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.153 -0.967 . . . . 0.0 110.975 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.432 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 51.4 mt-30 -65.64 -46.48 79.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.115 -0.991 . . . . 0.0 110.761 -179.505 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.477 ' CD2' ' N ' ' A' ' 63' ' ' LEU . 38.4 t80 -56.46 -67.49 0.3 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 111.007 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.477 ' N ' ' CD2' ' A' ' 62' ' ' PHE . 4.2 pp -59.17 -12.98 5.93 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.227 -0.921 . . . . 0.0 110.98 -179.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 t -88.59 -23.41 23.12 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.036 -1.04 . . . . 0.0 109.97 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 3.6 mm100 -97.67 -44.34 6.81 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.461 -0.774 . . . . 0.0 109.829 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.428 ' CG1' ' O ' ' A' ' 62' ' ' PHE . 1.8 p -98.45 91.67 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 109.935 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.436 ' C ' HG12 ' A' ' 68' ' ' ILE . 19.1 pttp -65.29 -177.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.44 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.559 ' CG2' ' HD2' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -151.09 149.92 26.12 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.286 -0.884 . . . . 0.0 109.52 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.559 ' HD2' ' CG2' ' A' ' 68' ' ' ILE . 44.8 Cg_endo -49.7 -177.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.807 1.425 . . . . 0.0 110.455 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.74 -3.42 42.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.294 -0.879 . . . . 0.0 110.683 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -23.15 29.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.096 -1.002 . . . . 0.0 109.934 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.52 ' CD1' ' O ' ' A' ' 8' ' ' LYS . 2.2 tp -94.58 106.34 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.393 -0.817 . . . . 0.0 110.212 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.409 HG21 ' N ' ' A' ' 74' ' ' VAL . 28.5 m -97.34 156.37 16.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.049 -1.032 . . . . 0.0 109.483 179.046 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.537 HG22 ' CG1' ' A' ' 5' ' ' VAL . 5.8 p -143.85 138.1 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 118.883 -1.127 . . . . 0.0 111.774 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 -179.22 3.94 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.899 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.6 p -128.33 155.67 44.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.214 -0.929 . . . . 0.0 110.124 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.34 -178.31 41.09 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -147.5 133.34 19.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.396 -1.061 . . . . 0.0 109.909 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 5.0 mtm -118.66 -179.91 3.94 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.242 -0.911 . . . . 0.0 110.55 -179.845 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' B' ' 76' ' ' THR . 21.6 p -142.41 110.15 5.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.307 -0.871 . . . . 0.0 109.973 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.1 tt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.301 -179.767 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.157 0.503 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.3 m -70.47 121.78 84.51 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.495 ' O ' HG22 ' B' ' 4' ' ' ILE . 47.3 Cg_endo -68.84 156.63 64.78 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 124.149 1.605 . . . . 0.0 110.512 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.495 HG22 ' O ' ' B' ' 3' ' ' PRO . 5.1 pt -142.5 168.9 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.349 -0.844 . . . . 0.0 109.887 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.536 ' CG1' HG22 ' B' ' 74' ' ' VAL . 5.3 t -145.76 124.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.206 -0.934 . . . . 0.0 110.269 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.482 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.0 OUTLIER -105.64 119.17 38.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.215 -0.928 . . . . 0.0 110.341 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.45 ' HG ' HG23 ' B' ' 74' ' ' VAL . 1.3 mp -116.56 147.32 41.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.3 -0.875 . . . . 0.0 110.198 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.509 ' O ' ' CD1' ' B' ' 72' ' ' ILE . 11.6 tttt -142.4 168.71 19.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 110.439 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.434 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 151.61 -165.96 30.65 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . 0.477 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 130.84 44.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -1.124 . . . . 0.0 110.196 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.28 -38.79 42.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.868 . . . . 0.0 110.67 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -66.56 -47.1 73.86 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.185 -0.947 . . . . 0.0 110.515 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 7.1 m -58.01 -28.32 64.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.21 -0.931 . . . . 0.0 110.539 -179.747 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.486 ' CD2' HD11 ' B' ' 72' ' ' ILE . 77.3 mt -77.37 -26.95 52.37 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 0.0 110.358 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -59.36 -39.67 84.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.194 -0.941 . . . . 0.0 110.343 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.47 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 0.8 OUTLIER -70.2 -34.22 72.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.216 -0.927 . . . . 0.0 110.367 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.503 HD13 ' N ' ' B' ' 17' ' ' LEU . 6.1 mp -58.8 -51.66 69.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.131 -0.98 . . . . 0.0 110.466 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.475 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 1.3 ttp-105 -46.16 -32.36 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.92 . . . . 0.0 110.098 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.47 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 48.8 t80 -64.91 -33.25 75.56 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -74.53 -30.19 61.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.264 -0.897 . . . . 0.0 110.503 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 11.3 m-30 -66.51 -21.58 66.17 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.208 -0.932 . . . . 0.0 110.459 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -63.5 -36.24 83.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.255 -0.903 . . . . 0.0 110.592 -179.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -75.12 -40.94 59.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.218 -0.926 . . . . 0.0 110.411 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.411 ' HB3' ' HB2' ' B' ' 27' ' ' LEU . 15.8 m-70 -95.07 36.28 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.464 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.568 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 31.8 p -57.38 -17.84 14.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.133 -0.98 . . . . 0.0 110.485 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.92 -3.28 42.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.111 -0.993 . . . . 0.0 110.396 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.411 ' HB2' ' HB3' ' B' ' 24' ' ' HIS . 10.9 mt -92.32 -6.22 50.69 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.556 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.568 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 20.7 p90 -145.04 -178.09 5.87 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.202 -0.936 . . . . 0.0 109.635 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 48.0 m -96.44 -69.19 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.91 -1.119 . . . . 0.0 110.589 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.46 20.99 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.955 -1.091 . . . . 0.0 109.065 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.464 ' CG1' ' O ' ' B' ' 31' ' ' VAL . 14.3 p -91.37 113.32 26.75 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.938 0 O-C-N 121.712 -0.617 . . . . 0.0 110.39 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.434 ' OG ' ' HB ' ' B' ' 50' ' ' THR . 70.7 p -53.08 152.55 4.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.006 -1.059 . . . . 0.0 109.56 179.404 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' SER . . . . . 0.472 ' OG ' ' HB2' ' A' ' 35' ' ' TRP . 0.9 OUTLIER -60.77 154.45 21.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.014 -1.054 . . . . 0.0 109.98 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -67.63 130.23 42.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.161 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.453 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 44.1 p-90 -146.09 176.04 10.02 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.313 -0.867 . . . . 0.0 109.929 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.478 ' CG ' ' H ' ' B' ' 37' ' ' TRP . 53.7 t-80 -162.55 178.05 8.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.427 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.478 ' H ' ' CG ' ' B' ' 36' ' ' HIS . 79.6 m95 -78.5 123.78 27.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.276 -0.89 . . . . 0.0 110.067 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' THR . . . . . 0.44 ' OG1' ' O ' ' B' ' 37' ' ' TRP . 1.7 m -171.87 159.44 5.17 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.32 -0.863 . . . . 0.0 109.869 -179.868 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.7 -125.7 2.69 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . 0.461 ' CB ' ' HE2' ' A' ' 22' ' ' LYS . 28.7 t-80 -91.44 -39.73 11.81 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.297 -1.119 . . . . 0.0 110.243 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -135.45 66.73 1.51 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.162 -0.961 . . . . 0.0 110.102 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.433 HG13 ' N ' ' B' ' 43' ' ' LYS . 43.5 t -121.56 170.57 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.268 -0.895 . . . . 0.0 110.123 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.433 ' N ' HG13 ' B' ' 42' ' ' VAL . 33.0 mtpt -94.1 176.86 6.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.271 -0.893 . . . . 0.0 110.237 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -114.82 136.31 53.23 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.287 -0.883 . . . . 0.0 110.045 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -110.37 -70.2 0.82 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -0.968 . . . . 0.0 110.48 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.485 ' O ' HG13 ' B' ' 48' ' ' ILE . 0.2 OUTLIER -154.16 106.41 2.8 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.474 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -40.51 157.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.448 -0.782 . . . . 0.0 110.008 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.485 HG13 ' O ' ' B' ' 46' ' ' SER . 70.2 mt -142.12 144.29 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.18 -0.95 . . . . 0.0 110.318 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 70.8 t -116.65 169.16 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 0.0 110.498 -179.798 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.438 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 17.2 m -146.04 152.96 40.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.295 -0.878 . . . . 0.0 109.804 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -136.01 128.47 30.43 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.132 -0.98 . . . . 0.0 110.232 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.417 ' OG1' ' CZ3' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.93 39.92 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.208 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.573 ' CD2' ' HA ' ' B' ' 59' ' ' ARG . 38.3 m-85 -112.31 147.69 35.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.264 -0.898 . . . . 0.0 110.034 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -93.45 -3.18 53.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.822 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 98.8 p -157.44 121.38 4.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.015 -1.053 . . . . 0.0 110.372 -179.874 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.465 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 2.3 mt-10 -46.99 -42.18 17.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.314 -0.867 . . . . 0.0 109.978 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . 0.429 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 16.1 t-105 -53.94 -55.83 23.38 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 17.1 tt0 -59.23 -31.06 68.71 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.408 -0.807 . . . . 0.0 110.52 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.573 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 0.0 OUTLIER -59.41 -54.7 43.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.18 -0.95 . . . . 0.0 110.96 -179.645 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . 0.418 ' O ' ' CB ' ' B' ' 64' ' ' SER . 19.6 t70 -61.12 -31.3 71.01 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.174 -0.954 . . . . 0.0 110.893 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.442 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 51.3 mt-30 -65.76 -46.55 78.39 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.116 -0.99 . . . . 0.0 110.668 -179.59 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.476 ' CD2' ' N ' ' B' ' 63' ' ' LEU . 41.5 t80 -56.43 -67.84 0.27 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.242 -0.911 . . . . 0.0 111.04 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.476 ' N ' ' CD2' ' B' ' 62' ' ' PHE . 4.1 pp -59.14 -12.93 5.78 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.306 -0.872 . . . . 0.0 110.792 -179.094 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 11.2 t -88.46 -23.36 23.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.172 -0.955 . . . . 0.0 109.901 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 3.5 mm-40 -98.2 -44.63 6.51 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.444 -0.785 . . . . 0.0 110.02 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.407 ' CG1' ' O ' ' B' ' 62' ' ' PHE . 1.9 p -98.12 90.9 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.359 -0.838 . . . . 0.0 110.008 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . 0.441 ' C ' HG12 ' B' ' 68' ' ' ILE . 19.0 pttp -64.48 -176.88 0.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.413 -0.804 . . . . 0.0 110.48 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.559 ' CG2' ' HD2' ' B' ' 69' ' ' PRO . 0.1 OUTLIER -151.44 149.93 25.55 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.405 -0.809 . . . . 0.0 109.682 -179.847 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.559 ' HD2' ' CG2' ' B' ' 68' ' ' ILE . 45.3 Cg_endo -49.35 -178.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.779 1.41 . . . . 0.0 110.655 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -4.0 43.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.288 -0.882 . . . . 0.0 110.581 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.63 -23.29 29.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.151 -0.968 . . . . 0.0 110.078 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.509 ' CD1' ' O ' ' B' ' 8' ' ' LYS . 1.9 tp -94.47 106.59 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 110.112 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' THR . . . . . 0.402 HG21 ' N ' ' B' ' 74' ' ' VAL . 26.8 m -97.35 156.06 16.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.044 -1.035 . . . . 0.0 109.408 179.021 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.536 HG22 ' CG1' ' B' ' 5' ' ' VAL . 6.0 p -143.91 138.39 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.85 -1.14 . . . . 0.0 111.63 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -179.37 3.98 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.009 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' THR . . . . . 0.436 ' O ' ' OG ' ' A' ' 80' ' ' SER . 5.5 p -128.19 155.46 44.47 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.01 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.72 -178.32 41.31 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -147.5 133.52 19.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.336 -1.097 . . . . 0.0 110.05 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 5.0 mtm -118.81 179.74 4.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.341 -0.85 . . . . 0.0 110.323 -179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 21.6 p -142.07 110.17 5.91 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.379 -0.825 . . . . 0.0 109.88 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.463 HG22 ' O ' ' B' ' 81' ' ' ILE . 13.8 tt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.384 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.4 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.222 0.534 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.43 142.65 89.51 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.262 -0.899 . . . . 0.0 110.107 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.502 ' O ' HG23 ' A' ' 4' ' ' ILE . 45.3 Cg_endo -92.5 137.22 1.6 Allowed 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.97 1.511 . . . . 0.0 110.227 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.502 HG23 ' O ' ' A' ' 3' ' ' PRO . 1.0 OUTLIER -142.8 176.05 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.861 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.548 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 12.4 p -146.11 153.69 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.199 -0.938 . . . . 0.0 110.466 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.578 ' CD2' HG22 ' A' ' 50' ' ' THR . 0.2 OUTLIER -133.75 108.89 8.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.481 -0.762 . . . . 0.0 109.765 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.513 ' HA ' ' O ' ' A' ' 73' ' ' THR . 2.4 pp -120.89 162.44 19.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.685 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 31.3 pttt -139.58 166.4 24.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.317 -0.864 . . . . 0.0 110.22 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.422 ' O ' HD13 ' A' ' 14' ' ' LEU . . . 167.11 178.72 39.65 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -65.34 136.4 56.48 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.304 -1.116 . . . . 0.0 110.508 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.08 -24.43 2.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.232 -0.917 . . . . 0.0 110.18 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -81.37 -51.38 8.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -57.86 -16.73 12.76 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.286 -0.883 . . . . 0.0 109.905 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.422 HD13 ' O ' ' A' ' 9' ' ' GLY . 15.7 mt -90.89 -28.98 17.77 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -0.838 . . . . 0.0 110.135 179.881 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -60.19 -48.83 80.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.277 -0.889 . . . . 0.0 110.675 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.2 t -70.02 -34.91 73.89 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 110.763 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.73 -48.1 82.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.148 -0.97 . . . . 0.0 110.56 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.66 ' CZ ' ' CD2' ' B' ' 40' ' ' HIS . 72.0 ttt-85 -47.69 -32.51 5.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.648 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -64.12 -25.81 68.26 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.945 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -73.68 -32.93 64.21 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.206 -0.934 . . . . 0.0 109.631 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.57 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 7.2 m-30 -66.72 -8.19 26.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.37 -0.831 . . . . 0.0 110.191 179.643 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . 0.416 ' HD3' ' HA ' ' A' ' 22' ' ' LYS . 33.7 mmtt -63.06 -49.82 73.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.157 -0.965 . . . . 0.0 109.856 -179.854 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -75.29 -25.93 58.33 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.248 -0.907 . . . . 0.0 109.772 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.469 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 18.1 m170 -95.27 29.61 2.45 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.377 -0.827 . . . . 0.0 110.018 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 p -57.26 -19.59 22.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.111 -0.993 . . . . 0.0 110.177 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.7 t -97.09 9.32 42.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.469 ' HB2' ' O ' ' A' ' 24' ' ' HIS . 4.2 mp -92.38 -33.07 14.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.123 -0.986 . . . . 0.0 110.628 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.5 p90 -118.76 168.88 10.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.964 -1.085 . . . . 0.0 110.255 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.67 -31.59 11.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.604 ' HB2' ' CE3' ' B' ' 37' ' ' TRP . . . -159.77 116.23 2.52 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.152 -0.967 . . . . 0.0 110.582 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.552 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 11.3 p -90.11 101.57 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.157 -0.964 . . . . 0.0 110.268 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.588 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 54.9 p -50.41 153.02 1.67 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.135 -0.978 . . . . 0.0 110.484 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.475 ' O ' ' OG1' ' A' ' 34' ' ' THR . 91.5 p -61.27 -96.43 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.274 -0.891 . . . . 0.0 110.506 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.475 ' OG1' ' O ' ' A' ' 33' ' ' SER . 3.2 m -171.55 125.19 0.6 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.414 -0.804 . . . . 0.0 110.036 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.535 ' CE3' ' HB2' ' B' ' 32' ' ' SER . 33.6 p-90 -147.09 -168.61 3.09 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.374 -0.829 . . . . 0.0 110.053 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.59 ' CE1' ' HB2' ' A' ' 45' ' ' LYS . 82.6 t60 -162.64 171.14 17.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.26 -0.9 . . . . 0.0 110.183 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.569 ' CE3' ' HB2' ' B' ' 30' ' ' ALA . 4.4 m95 -79.85 99.11 7.37 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.15 -0.969 . . . . 0.0 110.054 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.539 ' CG2' ' N ' ' A' ' 39' ' ' GLY . 2.3 m -170.14 -87.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 110.013 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.539 ' N ' ' CG2' ' A' ' 38' ' ' THR . . . 158.92 -130.61 2.54 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . 0.612 ' CD2' ' CZ ' ' B' ' 18' ' ' ARG . 7.0 p80 -68.79 -40.18 79.76 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.376 -1.073 . . . . 0.0 110.326 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.508 ' N ' ' CG ' ' A' ' 40' ' ' HIS . 24.0 t-20 -109.44 98.86 8.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.453 -0.78 . . . . 0.0 109.964 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.543 ' CG1' ' HB3' ' A' ' 36' ' ' HIS . 42.5 t -98.15 107.48 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.303 -0.873 . . . . 0.0 110.533 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.476 ' HD3' ' OD1' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -153.81 38.25 0.47 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.316 -0.865 . . . . 0.0 110.405 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -110.91 -69.35 0.87 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.176 -0.952 . . . . 0.0 110.264 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.59 ' HB2' ' CE1' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -98.32 -156.64 0.55 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.236 -0.915 . . . . 0.0 110.354 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 47' ' ' ALA . 2.8 t -97.0 134.4 40.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.035 -1.041 . . . . 0.0 110.954 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.524 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -41.55 163.53 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.479 -0.763 . . . . 0.0 110.168 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.524 HG13 ' C ' ' A' ' 47' ' ' ALA . 64.4 mt -142.42 162.13 18.92 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.177 -0.952 . . . . 0.0 110.102 -179.262 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.505 ' N ' HG21 ' A' ' 48' ' ' ILE . 4.6 t -135.95 167.98 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.702 -179.464 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.578 HG22 ' CD2' ' A' ' 6' ' ' HIS . 82.9 m -145.99 153.81 41.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.603 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.548 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 0.5 OUTLIER -136.33 136.04 39.37 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.045 -1.035 . . . . 0.0 110.219 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.529 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.61 125.28 40.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.444 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.479 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 38.1 m-85 -108.83 147.37 32.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 110.133 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -95.37 -16.92 22.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -140.26 126.84 20.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.184 -0.947 . . . . 0.0 110.296 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.436 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 4.3 mt-10 -53.99 -42.97 69.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.244 -0.91 . . . . 0.0 110.23 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 t-105 -53.58 -48.31 69.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -58.84 -36.31 74.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.371 -0.831 . . . . 0.0 110.088 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.508 ' NH2' HG22 ' A' ' 76' ' ' THR . 2.2 tmt_? -59.45 -45.51 91.4 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -60.99 -38.25 85.36 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.137 -0.977 . . . . 0.0 110.674 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -65.51 -39.23 91.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 110.53 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.464 ' CD1' ' N ' ' A' ' 63' ' ' LEU . 30.5 t80 -56.24 -65.2 0.65 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.356 -0.84 . . . . 0.0 111.036 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.482 ' C ' ' CD1' ' A' ' 63' ' ' LEU . 4.6 pp -59.64 -10.31 3.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.221 -0.924 . . . . 0.0 110.841 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 4.5 t -92.41 -23.61 19.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.098 -1.001 . . . . 0.0 110.699 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -95.5 -28.25 14.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.077 -1.015 . . . . 0.0 110.716 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.403 HG22 ' O ' ' A' ' 62' ' ' PHE . 3.5 m -109.37 75.07 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.044 -1.035 . . . . 0.0 110.138 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -50.83 111.57 0.57 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.288 -0.882 . . . . 0.0 110.229 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.46 HG23 ' HB ' ' A' ' 72' ' ' ILE . 0.5 OUTLIER -87.62 139.28 31.47 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 110.065 -179.647 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.458 ' HD2' HG23 ' A' ' 68' ' ' ILE . 46.2 Cg_endo -56.5 179.01 0.11 Allowed 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.211 1.637 . . . . 0.0 110.56 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -86.36 -0.62 56.3 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.338 -0.851 . . . . 0.0 110.195 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.0 p -84.42 -30.5 25.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.282 -0.886 . . . . 0.0 109.765 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.473 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 50.8 mt -94.34 114.76 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.013 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.513 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 7.0 m -95.53 146.08 24.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.195 -0.941 . . . . 0.0 109.933 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.526 ' CG2' ' CG2' ' A' ' 5' ' ' VAL . 8.2 p -145.2 154.32 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.129 -0.982 . . . . 0.0 110.749 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.431 ' N ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -139.99 -179.23 5.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 109.876 -179.899 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.508 HG22 ' NH2' ' A' ' 59' ' ' ARG . 52.4 p -107.09 163.81 12.68 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.381 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.411 ' HA3' HD12 ' A' ' 4' ' ' ILE . . . -165.45 -177.86 38.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -147.9 144.15 27.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.201 -1.176 . . . . 0.0 110.333 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 97.2 mtp -115.29 172.46 7.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.265 -0.897 . . . . 0.0 110.147 179.933 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.462 ' HB3' ' O ' ' B' ' 76' ' ' THR . 2.2 t -132.72 101.76 5.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.937 . . . . 0.0 110.483 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.438 HG23 ' O ' ' A' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.126 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mtp . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.246 0.546 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.97 143.81 92.22 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.266 -0.896 . . . . 0.0 110.27 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.499 ' O ' HG23 ' B' ' 4' ' ' ILE . 46.3 Cg_endo -93.4 137.14 1.29 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 O-C-N 124.03 1.542 . . . . 0.0 110.362 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.499 HG23 ' O ' ' B' ' 3' ' ' PRO . 1.0 OUTLIER -143.13 176.73 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.391 -0.818 . . . . 0.0 110.025 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 74' ' ' VAL . 12.3 p -146.44 154.04 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 110.413 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.514 ' CD2' HG22 ' B' ' 50' ' ' THR . 0.2 OUTLIER -133.92 108.42 8.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 0.0 109.667 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.514 ' HA ' ' O ' ' B' ' 73' ' ' THR . 2.5 pp -120.55 162.45 19.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.963 . . . . 0.0 110.687 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.482 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 31.9 pttt -139.69 166.31 24.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.26 -0.9 . . . . 0.0 110.256 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.438 ' O ' HD13 ' B' ' 14' ' ' LEU . . . 167.17 178.36 39.45 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 179.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -65.02 136.89 57.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.42 -1.047 . . . . 0.0 110.405 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.38 -25.13 3.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.325 -0.859 . . . . 0.0 110.117 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -80.52 -51.61 8.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.317 -0.864 . . . . 0.0 110.188 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 18.6 m -57.87 -16.54 12.14 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.248 -0.907 . . . . 0.0 110.041 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.438 HD13 ' O ' ' B' ' 9' ' ' GLY . 16.6 mt -91.16 -28.74 17.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 110.237 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 18.0 ttmt -60.15 -48.67 80.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.29 -0.881 . . . . 0.0 110.638 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -70.15 -34.98 73.7 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.172 -0.955 . . . . 0.0 110.865 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.65 -48.12 82.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.064 -1.023 . . . . 0.0 110.505 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.612 ' CZ ' ' CD2' ' A' ' 40' ' ' HIS . 71.4 ttt-85 -47.63 -32.64 5.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.593 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -64.28 -25.17 67.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -0.982 . . . . 0.0 109.953 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -74.69 -32.71 62.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.318 -0.864 . . . . 0.0 109.5 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 7.5 m-30 -66.65 -8.17 25.65 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 110.117 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . 0.412 ' HD3' ' HA ' ' B' ' 22' ' ' LYS . 35.2 mmtt -63.14 -50.09 71.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 -179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -75.14 -25.74 58.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.779 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.487 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 18.1 m170 -95.34 29.34 2.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.366 -0.834 . . . . 0.0 110.14 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 14.3 p -57.04 -19.73 20.6 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.104 -0.997 . . . . 0.0 110.208 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -97.06 9.54 41.82 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.851 . . . . 0.0 110.209 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' B' ' 24' ' ' HIS . 4.2 mp -92.31 -34.13 14.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.22 -0.925 . . . . 0.0 110.564 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -117.9 168.92 10.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.005 -1.06 . . . . 0.0 110.417 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.71 -31.48 11.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.312 -0.867 . . . . 0.0 110.828 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.569 ' HB2' ' CE3' ' A' ' 37' ' ' TRP . . . -159.67 116.47 2.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.054 -1.029 . . . . 0.0 110.58 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.545 ' CG1' ' O ' ' B' ' 31' ' ' VAL . 12.0 p -90.27 101.12 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.116 -0.99 . . . . 0.0 110.333 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.535 ' HB2' ' CE3' ' A' ' 35' ' ' TRP . 60.0 p -50.38 152.51 1.82 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.081 -1.012 . . . . 0.0 110.376 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' SER . . . . . 0.498 ' OG ' ' N ' ' B' ' 34' ' ' THR . 85.6 p -61.23 -95.93 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.884 . . . . 0.0 110.5 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.498 ' N ' ' OG ' ' B' ' 33' ' ' SER . 3.2 m -171.64 125.45 0.59 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.461 -0.774 . . . . 0.0 110.054 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.588 ' CE3' ' HB2' ' A' ' 32' ' ' SER . 36.1 p-90 -147.11 -168.77 3.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.375 -0.828 . . . . 0.0 110.075 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.589 ' CE1' ' HB2' ' B' ' 45' ' ' LYS . 82.2 t60 -162.58 170.77 18.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.146 -0.971 . . . . 0.0 110.079 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.604 ' CE3' ' HB2' ' A' ' 30' ' ' ALA . 4.5 m95 -79.91 98.34 7.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.112 -0.992 . . . . 0.0 110.154 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' THR . . . . . 0.539 ' CG2' ' HA ' ' B' ' 42' ' ' VAL . 2.3 m -169.38 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 0.0 110.189 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . 0.506 ' N ' ' CG2' ' B' ' 38' ' ' THR . . . 157.42 -130.67 2.68 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.89 -1.284 . . . . 0.0 109.89 179.839 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . 0.66 ' CD2' ' CZ ' ' A' ' 18' ' ' ARG . 6.8 p80 -69.44 -39.29 77.88 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.333 -1.098 . . . . 0.0 110.531 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . 0.501 ' N ' ' CG ' ' B' ' 40' ' ' HIS . 22.0 t-20 -110.22 97.18 6.71 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.279 -0.888 . . . . 0.0 110.055 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.547 ' CG1' ' HB3' ' B' ' 36' ' ' HIS . 42.3 t -96.41 108.92 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.184 -0.948 . . . . 0.0 110.449 -179.634 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.466 ' HD3' ' OD1' ' B' ' 41' ' ' ASN . 0.2 OUTLIER -155.87 39.57 0.37 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.323 -0.861 . . . . 0.0 110.021 179.903 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 22.0 m170 -111.94 -69.15 0.88 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.25 -0.906 . . . . 0.0 110.121 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . 0.589 ' HB2' ' CE1' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -99.13 -156.59 0.55 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.286 -0.884 . . . . 0.0 110.138 179.933 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.44 ' O ' ' O ' ' B' ' 47' ' ' ALA . 2.8 t -97.46 134.83 40.18 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.106 -0.996 . . . . 0.0 110.869 -179.442 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.522 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -41.9 163.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.473 -0.767 . . . . 0.0 110.277 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.522 HG13 ' C ' ' B' ' 47' ' ' ALA . 64.2 mt -142.38 162.43 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.227 -0.921 . . . . 0.0 110.12 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . 0.498 ' N ' HG21 ' B' ' 48' ' ' ILE . 4.9 t -136.49 168.05 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.098 -1.001 . . . . 0.0 110.725 -179.613 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.514 HG22 ' CD2' ' B' ' 6' ' ' HIS . 78.4 m -145.94 153.87 41.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.439 -0.788 . . . . 0.0 109.677 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.534 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 0.5 OUTLIER -136.52 135.89 38.89 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.08 -1.013 . . . . 0.0 110.295 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.466 ' OG1' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.59 124.98 40.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.505 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.48 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 40.5 m-85 -108.71 147.46 31.92 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.344 -0.848 . . . . 0.0 110.076 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -95.29 -17.66 21.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.094 -1.004 . . . . 0.0 110.273 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -139.22 127.33 22.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.403 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 4.2 mt-10 -54.37 -42.63 70.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 110.264 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -53.7 -48.45 69.55 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.209 -0.932 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -58.94 -36.04 74.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.098 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.515 ' NH2' HG22 ' B' ' 76' ' ' THR . 1.8 tmt_? -59.2 -45.73 90.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -0.847 . . . . 0.0 110.915 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.02 -37.94 84.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.027 -1.046 . . . . 0.0 110.774 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -65.67 -38.96 90.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.15 -0.968 . . . . 0.0 110.448 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.456 ' CD1' ' N ' ' B' ' 63' ' ' LEU . 31.4 t80 -56.25 -65.17 0.65 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.227 -0.921 . . . . 0.0 110.987 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.474 ' CD1' ' C ' ' B' ' 63' ' ' LEU . 4.6 pp -59.59 -11.54 5.0 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.292 -0.88 . . . . 0.0 110.951 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 4.8 t -91.11 -23.48 20.28 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.014 -1.054 . . . . 0.0 110.663 -179.502 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -95.57 -28.58 14.78 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.093 -1.005 . . . . 0.0 110.769 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.4 HG22 ' O ' ' B' ' 62' ' ' PHE . 3.5 m -109.02 74.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.095 -1.003 . . . . 0.0 110.231 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -50.12 111.67 0.56 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.382 -0.823 . . . . 0.0 110.108 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.469 HG23 ' HD2' ' B' ' 69' ' ' PRO . 0.5 OUTLIER -87.67 139.56 31.41 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.085 -1.01 . . . . 0.0 110.035 -179.638 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.469 ' HD2' HG23 ' B' ' 68' ' ' ILE . 47.3 Cg_endo -56.85 178.92 0.12 Allowed 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 124.156 1.608 . . . . 0.0 110.518 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -86.07 -0.8 56.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 58.8 p -84.41 -30.29 25.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.19 -0.944 . . . . 0.0 109.7 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.482 ' HA ' ' O ' ' B' ' 8' ' ' LYS . 47.9 mt -94.51 114.68 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.394 -0.816 . . . . 0.0 110.079 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' THR . . . . . 0.514 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.0 m -95.42 146.23 24.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 110.002 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 5' ' ' VAL . 8.4 p -145.22 154.34 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.159 -0.963 . . . . 0.0 110.857 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' SER . . . . . 0.429 ' N ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -140.43 -179.5 6.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.493 -0.754 . . . . 0.0 109.89 -179.935 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' THR . . . . . 0.515 HG22 ' NH2' ' B' ' 59' ' ' ARG . 54.2 p -106.73 163.87 12.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.196 -0.94 . . . . 0.0 110.344 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -165.47 -177.52 37.87 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -148.24 144.23 27.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.151 -1.205 . . . . 0.0 110.347 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 96.6 mtp -115.18 172.95 6.76 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.283 -0.885 . . . . 0.0 110.108 179.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.434 ' O ' HG23 ' B' ' 81' ' ' ILE . 2.2 t -133.21 102.36 5.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 0.0 110.312 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.434 HG23 ' O ' ' B' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.41 ' HE3' ' O ' ' A' ' 79' ' ' MET . 3.4 mmm . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 121.306 0.574 . . . . 0.0 110.195 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.522 ' O ' ' CG ' ' A' ' 79' ' ' MET . 0.3 OUTLIER -103.14 101.31 21.2 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 110.186 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.508 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -56.37 164.42 5.42 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.904 1.476 . . . . 0.0 110.243 -179.846 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' A' ' 77' ' ' GLY . 1.3 pt -144.01 125.39 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.172 -0.955 . . . . 0.0 110.187 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.528 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 5.6 p -94.34 132.56 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.211 -0.931 . . . . 0.0 110.246 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.552 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -105.28 126.23 51.87 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.767 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.482 ' CD1' ' CG2' ' A' ' 72' ' ' ILE . 13.0 tp -115.01 133.65 55.86 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.16 -0.962 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.509 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.1 tttt -141.15 166.38 24.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.335 -0.853 . . . . 0.0 109.974 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.509 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.32 -171.55 32.22 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.751 -1.339 . . . . 0.0 109.751 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.0 136.08 56.38 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -1.158 . . . . 0.0 110.39 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.491 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.81 -48.41 59.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.303 -0.873 . . . . 0.0 110.652 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.8 -56.17 13.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.082 -1.011 . . . . 0.0 110.487 -179.534 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.401 HG22 HD13 ' A' ' 72' ' ' ILE . 4.4 m -58.19 -26.0 62.26 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.164 -0.96 . . . . 0.0 110.786 -179.639 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.491 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 56.1 mt -71.86 -31.89 66.92 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.117 -0.989 . . . . 0.0 110.379 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -59.69 -42.7 93.53 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.216 -0.928 . . . . 0.0 110.567 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.4 -37.53 74.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.212 -0.93 . . . . 0.0 111.002 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.458 HD12 HG12 ' A' ' 72' ' ' ILE . 42.8 mt -58.8 -55.44 35.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.071 -1.018 . . . . 0.0 110.594 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttp85 -45.59 -21.55 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.241 -0.912 . . . . 0.0 110.919 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 17' ' ' LEU . 67.0 t80 -64.41 -59.33 4.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.083 -1.011 . . . . 0.0 110.678 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.5 mtt-85 -68.16 -14.72 63.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 0.0 110.417 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.62 -41.05 88.98 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.253 -0.904 . . . . 0.0 110.573 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -63.51 -25.13 68.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.171 -0.955 . . . . 0.0 110.668 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -75.28 -38.66 60.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 110.575 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.533 ' HB3' ' CD1' ' A' ' 27' ' ' LEU . 23.1 m-70 -94.73 45.25 1.11 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.399 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.588 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 20.0 p -57.32 -16.1 7.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.349 -0.844 . . . . 0.0 110.229 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.448 HG22 ' SG ' ' A' ' 25' ' ' CYS . 65.3 p -96.85 3.62 52.11 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.454 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.533 ' CD1' ' HB3' ' A' ' 24' ' ' HIS . 8.0 mt -91.75 -26.28 18.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 0.0 110.137 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.588 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 44.0 p90 -122.13 174.22 7.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.158 -0.964 . . . . 0.0 109.936 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.6 m -101.0 -36.36 9.05 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.118 -0.989 . . . . 0.0 111.949 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.493 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -160.51 123.99 3.47 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.855 -1.153 . . . . 0.0 110.941 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.533 HG12 ' HA2' ' B' ' 39' ' ' GLY . 8.5 p -89.62 120.46 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.176 -0.952 . . . . 0.0 110.049 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.625 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 4.4 p -84.21 150.18 25.64 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.321 -0.862 . . . . 0.0 110.953 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.39 158.52 14.4 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.523 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.5 m -67.77 134.58 51.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.021 -1.049 . . . . 0.0 109.962 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.668 ' CD2' ' O ' ' A' ' 35' ' ' TRP . 46.9 p-90 -145.49 120.7 10.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.106 -0.996 . . . . 0.0 109.917 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.626 ' CE1' ' CG1' ' A' ' 42' ' ' VAL . 0.3 OUTLIER -79.02 161.29 26.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.212 -0.93 . . . . 0.0 110.614 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.57 ' HA ' ' CE3' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -78.62 55.5 1.66 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.929 179.761 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.6 HG21 ' CD2' ' A' ' 36' ' ' HIS . 6.0 t -148.3 -179.21 6.78 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.197 -0.939 . . . . 0.0 110.228 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.519 ' HA2' HG12 ' B' ' 31' ' ' VAL . . . -71.21 174.55 40.89 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 41.7 t60 -61.19 -63.36 1.32 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.236 -1.155 . . . . 0.0 110.192 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -65.5 95.41 0.21 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.873 . . . . 0.0 110.607 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.626 ' CG1' ' CE1' ' A' ' 36' ' ' HIS . 12.7 p -150.16 156.57 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.215 -0.928 . . . . 0.0 110.13 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.463 ' N ' HG21 ' A' ' 42' ' ' VAL . 1.2 mtpt -129.34 -26.0 2.61 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.214 -0.929 . . . . 0.0 110.553 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.44 ' C ' ' O ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -41.55 148.62 0.14 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.242 -0.911 . . . . 0.0 110.276 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.424 ' C ' ' OG ' ' A' ' 46' ' ' SER . 5.3 tttm -68.18 114.62 6.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 110.338 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.424 ' OG ' ' C ' ' A' ' 45' ' ' LYS . 1.3 m -162.61 148.94 12.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.314 -0.866 . . . . 0.0 109.85 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -175.87 125.16 0.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.151 -0.968 . . . . 0.0 110.118 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.429 ' CG2' ' O ' ' A' ' 7' ' ' LEU . 25.9 mt -141.5 140.97 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.162 -0.961 . . . . 0.0 110.599 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 48.5 t -121.94 117.81 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.386 -0.821 . . . . 0.0 109.933 179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.431 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 39.2 m -94.15 154.63 17.48 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.192 -0.943 . . . . 0.0 110.49 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.528 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 5.6 mp -135.91 134.72 39.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.234 -0.916 . . . . 0.0 109.889 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.567 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.85 127.49 42.88 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.324 -0.86 . . . . 0.0 110.757 -179.44 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.508 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 15.9 m-85 -109.13 147.84 31.82 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.459 -0.775 . . . . 0.0 109.976 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -88.22 -10.09 50.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.23 -0.919 . . . . 0.0 110.765 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.19 132.42 10.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.116 -0.99 . . . . 0.0 110.319 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.441 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 30.1 mm-40 -54.47 -38.15 66.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.304 -0.873 . . . . 0.0 110.054 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -53.65 -53.54 50.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.025 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -57.07 -27.23 61.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.421 -0.8 . . . . 0.0 110.256 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.441 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 25.0 ttt-85 -59.62 -49.57 77.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.182 -0.949 . . . . 0.0 110.257 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -61.37 -33.09 73.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.364 -0.835 . . . . 0.0 110.914 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -65.19 -49.59 69.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.988 -1.07 . . . . 0.0 110.158 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.529 ' C ' ' CD1' ' A' ' 62' ' ' PHE . 0.6 OUTLIER -55.4 -41.43 72.69 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.214 -0.929 . . . . 0.0 109.639 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 2.6 mt -59.77 -24.61 64.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.426 -0.796 . . . . 0.0 110.374 179.813 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.7 p -91.77 -19.01 23.04 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.165 -0.959 . . . . 0.0 110.32 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.74 -17.26 20.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.21 -0.931 . . . . 0.0 110.141 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 30.9 t -102.17 97.46 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.319 -0.863 . . . . 0.0 110.329 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.524 ' O ' ' CD ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -56.62 104.52 0.15 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.224 -0.922 . . . . 0.0 110.15 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.46 HG23 ' HB ' ' A' ' 72' ' ' ILE . 7.0 mt -89.85 136.44 29.23 Favored Pre-proline 0 C--N 1.301 -1.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.278 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.429 ' HG2' HD11 ' A' ' 72' ' ' ILE . 45.8 Cg_endo -76.76 -158.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.034 1.544 . . . . 0.0 110.214 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 39.0 mttp -100.92 45.38 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.491 -179.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.69 -10.87 0.13 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.063 -1.023 . . . . 0.0 112.1 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.581 ' N ' ' CD1' ' A' ' 72' ' ' ILE . 1.2 mp -94.2 113.74 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 120.596 -1.315 . . . . 0.0 109.962 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.5 m -95.59 144.38 26.09 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.104 -0.997 . . . . 0.0 110.449 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 24.7 t -90.15 167.09 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 111.085 -178.889 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.552 ' HB2' ' CB ' ' A' ' 6' ' ' HIS . 1.2 m -144.39 164.45 30.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.671 -0.643 . . . . 0.0 110.895 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.7 p -133.93 156.22 48.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.438 -0.788 . . . . 0.0 109.282 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' A' ' 4' ' ' ILE . . . 176.11 138.58 2.9 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -92.57 140.56 29.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.129 -1.218 . . . . 0.0 110.255 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.522 ' CG ' ' O ' ' A' ' 2' ' ' THR . 2.8 ppp? -126.91 168.55 14.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.138 -0.976 . . . . 0.0 110.309 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.463 ' O ' HG13 ' A' ' 81' ' ' ILE . 0.5 OUTLIER -148.86 108.97 4.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.243 -0.91 . . . . 0.0 110.25 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.463 HG13 ' O ' ' A' ' 80' ' ' SER . 27.7 mt . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.194 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.435 ' HE3' ' O ' ' B' ' 79' ' ' MET . 3.2 mmm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.278 0.561 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.546 ' O ' ' CG ' ' B' ' 79' ' ' MET . 0.3 OUTLIER -102.84 100.52 16.86 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.216 -0.927 . . . . 0.0 110.285 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.3 Cg_endo -55.5 164.58 4.01 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 O-C-N 123.974 1.513 . . . . 0.0 110.325 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' B' ' 77' ' ' GLY . 1.3 pt -144.29 125.1 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.936 . . . . 0.0 110.227 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.522 ' CG1' ' HB2' ' B' ' 51' ' ' LEU . 5.5 p -94.23 132.41 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.13 -0.981 . . . . 0.0 110.303 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.556 ' CB ' ' HB2' ' B' ' 75' ' ' SER . 0.0 OUTLIER -105.07 126.5 52.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 109.9 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.473 ' CD1' ' CG2' ' B' ' 72' ' ' ILE . 13.4 tp -115.34 133.57 55.91 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.089 -1.007 . . . . 0.0 110.591 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.521 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 8.7 tttt -141.2 166.47 24.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.326 -0.859 . . . . 0.0 109.885 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.521 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.53 -171.28 32.36 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.96 136.27 56.62 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.36 -1.083 . . . . 0.0 110.354 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.493 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.7 -49.38 57.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.382 -0.823 . . . . 0.0 110.607 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.11 -56.13 12.15 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.704 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.4 HG22 HD13 ' B' ' 72' ' ' ILE . 4.2 m -58.0 -26.85 62.91 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.182 -0.949 . . . . 0.0 110.846 -179.581 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.493 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 60.1 mt -70.98 -31.86 68.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.104 -0.998 . . . . 0.0 110.52 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -59.75 -42.66 93.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.625 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 6.0 t -70.17 -37.32 75.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.195 -0.941 . . . . 0.0 110.837 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.465 HD12 HG12 ' B' ' 72' ' ' ILE . 48.7 mt -58.8 -55.81 30.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.252 -0.905 . . . . 0.0 110.708 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ttp85 -45.75 -21.16 0.1 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.88 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' B' ' 17' ' ' LEU . 67.2 t80 -64.58 -60.18 3.42 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.025 -1.047 . . . . 0.0 110.527 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 48.2 mtt-85 -67.48 -14.73 63.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.165 -0.96 . . . . 0.0 110.473 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.64 -40.83 88.87 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.193 -0.942 . . . . 0.0 110.585 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 20.4 mmtp -63.37 -25.45 68.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.26 -0.9 . . . . 0.0 110.677 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.18 -39.04 60.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 110.574 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.512 ' HB3' ' CD1' ' B' ' 27' ' ' LEU . 23.9 m-70 -94.35 45.12 1.12 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.083 -1.011 . . . . 0.0 110.276 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.604 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 20.9 p -57.14 -15.91 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.212 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.434 HG22 ' SG ' ' B' ' 25' ' ' CYS . 80.4 p -96.86 3.09 52.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.325 -0.859 . . . . 0.0 110.446 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.512 ' CD1' ' HB3' ' B' ' 24' ' ' HIS . 8.2 mt -91.75 -25.64 18.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.158 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 44.5 p90 -122.5 173.82 7.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.147 -0.971 . . . . 0.0 109.958 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -100.69 -36.13 9.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.986 -1.071 . . . . 0.0 111.742 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . 0.485 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -160.68 123.93 3.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.845 -1.159 . . . . 0.0 111.059 -179.697 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.519 HG12 ' HA2' ' A' ' 39' ' ' GLY . 8.7 p -89.47 119.95 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.161 -0.962 . . . . 0.0 110.037 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.629 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 3.9 p -83.92 150.82 25.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.298 -0.876 . . . . 0.0 110.832 -179.385 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.45 158.81 13.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.027 -1.045 . . . . 0.0 109.734 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.0 m -68.01 134.76 51.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.028 -1.045 . . . . 0.0 109.899 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.664 ' CD2' ' O ' ' B' ' 35' ' ' TRP . 46.1 p-90 -145.83 120.6 9.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.101 -1.0 . . . . 0.0 109.937 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.633 ' CE1' ' CG1' ' B' ' 42' ' ' VAL . 0.3 OUTLIER -78.94 161.3 26.78 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.235 -0.915 . . . . 0.0 110.593 -179.646 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.579 ' HA ' ' CE3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -78.65 53.48 1.34 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.259 -0.9 . . . . 0.0 110.165 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' THR . . . . . 0.588 HG21 ' CD2' ' B' ' 36' ' ' HIS . 6.6 t -146.53 -179.41 6.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.363 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . 0.533 ' HA2' HG12 ' A' ' 31' ' ' VAL . . . -69.6 175.32 33.93 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -62.32 -63.05 1.35 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.206 -1.173 . . . . 0.0 110.107 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -65.59 96.89 0.28 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.373 -0.829 . . . . 0.0 110.253 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.633 ' CG1' ' CE1' ' B' ' 36' ' ' HIS . 12.7 p -151.44 155.08 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.353 -0.842 . . . . 0.0 110.071 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.453 ' N ' HG21 ' B' ' 42' ' ' VAL . 1.3 mtpt -128.09 -26.15 2.91 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.161 -0.962 . . . . 0.0 110.635 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . 0.443 ' C ' ' O ' ' B' ' 43' ' ' LYS . 0.1 OUTLIER -41.33 149.16 0.11 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.242 -0.911 . . . . 0.0 110.314 -179.714 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . 0.427 ' C ' ' OG ' ' B' ' 46' ' ' SER . 5.6 tttm -68.74 114.71 7.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.891 . . . . 0.0 110.442 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.427 ' OG ' ' C ' ' B' ' 45' ' ' LYS . 1.3 m -162.55 149.47 13.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.083 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.414 ' HB1' ' O ' ' B' ' 46' ' ' SER . . . -176.52 125.36 0.18 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.177 -0.952 . . . . 0.0 110.286 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.466 HG12 ' HG3' ' B' ' 8' ' ' LYS . 40.8 mt -141.87 140.99 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.2 -0.937 . . . . 0.0 110.617 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 48.1 t -121.67 117.81 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 0.0 109.943 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.453 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 34.9 m -93.95 154.32 17.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 110.374 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.522 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 5.7 mp -135.81 134.78 39.27 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 109.804 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.558 ' OG1' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.84 127.59 42.97 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 110.627 -179.542 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.501 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 16.1 m-85 -109.43 148.02 31.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.449 -0.782 . . . . 0.0 109.737 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -88.25 -9.73 51.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.131 -0.981 . . . . 0.0 110.725 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.07 133.01 10.51 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 28.5 mm-40 -55.31 -38.34 68.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -0.875 . . . . 0.0 109.984 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -53.57 -53.29 53.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.34 -0.85 . . . . 0.0 109.884 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -56.72 -27.99 60.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 110.143 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.444 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 24.0 ttt-85 -59.54 -49.17 78.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.19 -0.944 . . . . 0.0 110.395 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -61.47 -33.02 73.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.242 -0.911 . . . . 0.0 110.899 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -65.37 -49.85 67.74 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.152 -0.968 . . . . 0.0 110.063 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.525 ' C ' ' CD1' ' B' ' 62' ' ' PHE . 0.6 OUTLIER -55.52 -41.11 72.69 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.275 -0.891 . . . . 0.0 109.642 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 2.6 mt -59.75 -25.58 64.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.413 -0.804 . . . . 0.0 110.178 179.754 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 26.0 p -90.48 -19.5 23.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.62 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.83 -17.1 20.42 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.41 HG23 ' CD2' ' B' ' 62' ' ' PHE . 34.8 t -102.04 96.94 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.211 -0.931 . . . . 0.0 110.374 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . 0.526 ' CD ' ' O ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -56.13 104.32 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 110.254 179.872 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.458 HG23 ' HB ' ' B' ' 72' ' ' ILE . 6.8 mt -89.88 136.88 28.66 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.92 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.44 ' HG2' HD11 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -77.19 -157.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.127 1.593 . . . . 0.0 110.296 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 39.3 mttp -101.5 45.24 0.98 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 110.368 -179.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -154.76 -10.72 0.13 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.094 -1.004 . . . . 0.0 112.04 -179.745 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.576 ' N ' ' CD1' ' B' ' 72' ' ' ILE . 1.2 mp -94.38 113.84 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 120.553 -1.342 . . . . 0.0 109.971 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m -95.44 144.24 26.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.037 -1.039 . . . . 0.0 110.351 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 24.1 t -90.13 167.14 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 111.084 -178.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' SER . . . . . 0.556 ' HB2' ' CB ' ' B' ' 6' ' ' HIS . 1.3 m -144.59 163.72 33.06 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.409 0.623 . . . . 0.0 110.955 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.3 p -133.13 156.91 46.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.5 -0.75 . . . . 0.0 109.222 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' B' ' 4' ' ' ILE . . . 175.69 138.72 2.89 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -92.71 140.63 29.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.074 -1.251 . . . . 0.0 110.243 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.546 ' CG ' ' O ' ' B' ' 2' ' ' THR . 2.7 ppp? -126.55 169.38 13.13 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 110.19 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.46 ' O ' HG13 ' B' ' 81' ' ' ILE . 0.5 OUTLIER -149.95 108.77 3.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.216 -0.928 . . . . 0.0 110.127 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.46 HG13 ' O ' ' B' ' 80' ' ' SER . 27.0 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.583 ' HB2' ' CE2' ' A' ' 78' ' ' PHE . 1.8 mtp . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.116 0.484 . . . . 0.0 110.094 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -98.79 122.34 53.27 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.133 -0.979 . . . . 0.0 110.734 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.518 ' O ' HG23 ' A' ' 4' ' ' ILE . 46.7 Cg_endo -80.41 164.04 21.65 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 124.023 1.538 . . . . 0.0 109.716 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.518 HG23 ' O ' ' A' ' 3' ' ' PRO . 4.7 pt -143.26 124.0 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.07 -1.018 . . . . 0.0 110.755 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.427 ' O ' ' CG1' ' A' ' 5' ' ' VAL . 11.2 p -95.14 124.68 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.441 -0.787 . . . . 0.0 110.353 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.486 ' O ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -107.24 127.57 53.65 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.154 -0.966 . . . . 0.0 110.272 179.755 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.479 ' HA ' ' O ' ' A' ' 73' ' ' THR . 0.7 OUTLIER -129.29 153.58 47.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.06 -1.025 . . . . 0.0 110.507 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.478 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 1.2 ttpm? -141.85 169.8 16.91 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.179 -0.951 . . . . 0.0 110.2 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.478 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.22 -175.46 31.66 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -65.05 146.47 54.96 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -1.076 . . . . 0.0 110.549 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.42 -48.64 56.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.343 -0.848 . . . . 0.0 110.421 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.435 ' OD1' ' N ' ' A' ' 12' ' ' ASN . 3.3 m120 -53.93 -48.87 69.78 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.156 -0.965 . . . . 0.0 110.678 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.46 HG22 ' OG1' ' A' ' 71' ' ' THR . 0.2 OUTLIER -58.27 -20.61 43.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.239 -0.913 . . . . 0.0 110.98 -179.604 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 51.5 mt -75.61 -39.41 57.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.059 -1.025 . . . . 0.0 110.607 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -60.29 -26.39 66.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.154 -0.966 . . . . 0.0 110.505 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.503 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 29.1 t -69.94 -54.01 15.27 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.285 -0.885 . . . . 0.0 110.843 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 42.2 mt -59.19 -53.19 61.13 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.048 -1.033 . . . . 0.0 110.566 -179.592 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.437 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -46.63 -25.63 0.75 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.422 -0.799 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.503 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 39.1 t80 -64.85 -39.95 94.37 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.968 -1.082 . . . . 0.0 110.514 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.26 -23.76 60.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.514 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.531 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.3 m-30 -66.42 -27.94 68.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.167 -0.958 . . . . 0.0 110.346 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mmtt -63.58 -42.46 98.31 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.238 -0.914 . . . . 0.0 110.151 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 mmtm -75.12 -40.35 59.92 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.323 -0.861 . . . . 0.0 110.353 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 41.5 m-70 -94.91 39.63 1.1 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.228 -0.92 . . . . 0.0 110.446 -179.815 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.469 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 10.1 p -57.5 -14.69 5.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.267 -0.896 . . . . 0.0 110.593 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.8 p -96.77 3.97 52.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.972 . . . . 0.0 110.403 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 mp -92.28 -22.89 19.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.234 -0.916 . . . . 0.0 110.434 -179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.469 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 37.4 p90 -130.06 -177.1 4.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.191 -0.943 . . . . 0.0 109.799 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.9 m -95.67 -64.23 1.08 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.016 -1.052 . . . . 0.0 110.333 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.52 145.5 18.97 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.785 -1.197 . . . . 0.0 109.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.44 HG11 ' O ' ' A' ' 31' ' ' VAL . 7.4 p -91.77 102.6 13.69 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.634 -0.666 . . . . 0.0 110.418 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.454 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 2.6 p -52.35 154.52 2.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.08 -1.013 . . . . 0.0 109.598 179.608 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 p -60.56 158.77 11.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.146 -0.971 . . . . 0.0 110.07 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -67.54 126.25 28.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.142 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.502 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 32.7 p-90 -146.24 173.27 12.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.987 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.502 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 4.9 t60 -162.72 -178.26 6.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.125 -0.984 . . . . 0.0 110.687 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.433 ' H ' ' CG ' ' A' ' 36' ' ' HIS . 48.8 m95 -79.37 92.37 5.18 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.469 -0.769 . . . . 0.0 110.158 179.942 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.458 ' HB ' HG11 ' A' ' 42' ' ' VAL . 72.6 p -127.55 -142.2 0.27 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.291 -0.881 . . . . 0.0 110.399 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -168.46 -52.63 0.03 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.311 -1.516 . . . . 0.0 109.311 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 -159.67 -61.99 0.07 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -1.083 . . . . 0.0 110.028 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -78.21 108.8 11.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.307 -0.87 . . . . 0.0 109.954 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.458 HG11 ' HB ' ' A' ' 38' ' ' THR . 0.1 OUTLIER -131.51 135.49 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.186 -0.946 . . . . 0.0 109.975 -179.851 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.501 ' HD3' ' CG ' ' A' ' 44' ' ' HIS . 4.4 tttt -150.54 -38.8 0.13 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.248 -0.908 . . . . 0.0 110.199 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.598 ' CD2' ' O ' ' A' ' 44' ' ' HIS . 0.5 OUTLIER -147.48 94.89 2.44 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.2 -0.937 . . . . 0.0 110.303 179.774 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -138.19 177.76 7.64 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.15 -0.969 . . . . 0.0 110.144 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.547 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.1 OUTLIER -83.31 73.53 10.13 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.191 -0.943 . . . . 0.0 110.311 -179.961 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -45.7 154.66 0.2 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.462 -0.774 . . . . 0.0 110.52 -179.731 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.547 HG13 ' O ' ' A' ' 46' ' ' SER . 58.0 mt -145.92 150.33 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.333 -0.855 . . . . 0.0 110.435 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.511 ' N ' HG22 ' A' ' 48' ' ' ILE . 2.1 t -122.71 170.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 109.805 179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.501 HG23 ' N ' ' A' ' 51' ' ' LEU . 60.9 m -145.76 156.58 43.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.065 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.501 ' N ' HG23 ' A' ' 50' ' ' THR . 2.2 mp -136.24 133.11 36.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.223 -0.923 . . . . 0.0 110.31 -179.964 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.509 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 18.5 m -96.81 130.57 44.05 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.361 -0.837 . . . . 0.0 110.219 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.542 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 11.7 m-85 -110.43 147.99 32.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.178 -0.951 . . . . 0.0 109.987 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -78.9 -3.42 44.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.145 -0.972 . . . . 0.0 110.669 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.49 139.65 1.67 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -56.63 -31.93 64.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.907 . . . . 0.0 109.785 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -55.05 -59.74 4.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.606 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -57.31 -36.76 71.5 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.913 . . . . 0.0 111.152 -178.657 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 ttp85 -59.26 -40.98 87.74 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.984 -1.072 . . . . 0.0 110.512 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.54 -40.91 96.37 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.273 -0.892 . . . . 0.0 110.745 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -65.66 -40.35 92.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.121 -0.987 . . . . 0.0 110.537 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.405 ' CE2' HG21 ' A' ' 66' ' ' VAL . 9.4 t80 -55.45 -45.5 76.83 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.153 -0.967 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.55 -16.56 25.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.38 -0.825 . . . . 0.0 110.382 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -22.73 19.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.12 -0.987 . . . . 0.0 110.309 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -95.51 -26.52 15.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.038 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.505 ' O ' HG13 ' A' ' 68' ' ' ILE . 87.0 t -107.09 75.07 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.874 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.78 104.68 0.47 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.197 -0.94 . . . . 0.0 109.886 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.505 HG13 ' O ' ' A' ' 66' ' ' VAL . 0.8 OUTLIER -88.51 134.92 33.26 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.278 -0.889 . . . . 0.0 109.701 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.482 ' O ' ' O ' ' A' ' 68' ' ' ILE . 44.4 Cg_endo -54.77 -160.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.172 1.617 . . . . 0.0 110.561 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.466 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 tttm -95.47 2.98 54.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.907 -179.295 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.46 ' OG1' HG22 ' A' ' 13' ' ' THR . 4.5 p -85.24 -28.59 25.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.076 -1.015 . . . . 0.0 110.774 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.477 ' HB ' ' CG2' ' A' ' 68' ' ' ILE . 12.8 mm -94.21 124.57 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.479 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 6.4 t -96.34 138.3 34.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.361 -0.837 . . . . 0.0 110.011 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.01 165.81 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.083 -1.011 . . . . 0.0 111.103 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.486 ' HB2' ' O ' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.23 155.43 45.26 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 110.524 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.6 p -133.67 134.15 42.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.288 -0.882 . . . . 0.0 110.339 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.49 -169.38 25.79 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.599 -1.401 . . . . 0.0 109.599 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.583 ' CE2' ' HB2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -148.07 150.86 34.66 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.378 -1.072 . . . . 0.0 110.165 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 26.6 mtp -122.72 158.24 30.56 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.479 ' O ' HG13 ' A' ' 81' ' ' ILE . 0.2 OUTLIER -144.42 111.89 6.06 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 110.114 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.479 HG13 ' O ' ' A' ' 80' ' ' SER . 3.1 mp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.144 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.585 ' HB2' ' CE2' ' B' ' 78' ' ' PHE . 1.7 mtp . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.194 0.521 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 17.6 p -98.52 122.55 53.12 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 0.0 110.678 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.514 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 46.4 Cg_endo -80.69 163.88 21.0 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 123.982 1.517 . . . . 0.0 109.949 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.511 HG23 ' O ' ' B' ' 3' ' ' PRO . 4.9 pt -142.94 123.68 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.108 -0.995 . . . . 0.0 110.813 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.423 ' O ' ' CG1' ' B' ' 5' ' ' VAL . 11.5 p -94.78 124.94 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 110.319 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.5 ' O ' ' HB2' ' B' ' 75' ' ' SER . 0.0 OUTLIER -107.07 127.16 53.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.197 -0.939 . . . . 0.0 110.192 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.476 ' HA ' ' O ' ' B' ' 73' ' ' THR . 0.7 OUTLIER -129.11 153.31 47.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.048 -1.032 . . . . 0.0 110.457 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.48 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 1.2 ttpm? -142.05 169.95 16.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.285 -0.885 . . . . 0.0 110.192 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.48 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.04 -175.27 31.6 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.09 146.01 55.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.29 -1.124 . . . . 0.0 110.583 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.48 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.17 -47.05 54.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.389 -0.819 . . . . 0.0 110.631 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . 0.448 ' OD1' ' N ' ' B' ' 12' ' ' ASN . 3.1 m120 -56.05 -48.32 76.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.13 -0.981 . . . . 0.0 110.649 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.476 HG22 ' OG1' ' B' ' 71' ' ' THR . 0.2 OUTLIER -58.15 -21.28 46.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.221 -0.924 . . . . 0.0 110.69 -179.563 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 54.5 mt -74.63 -39.81 61.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.99 -1.069 . . . . 0.0 110.647 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.48 -26.17 66.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.144 -0.973 . . . . 0.0 110.619 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.511 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 29.4 t -69.81 -53.77 16.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 110.768 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 39.8 mt -59.23 -53.55 56.95 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.16 -0.962 . . . . 0.0 110.616 -179.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.434 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 0.3 OUTLIER -46.47 -25.51 0.69 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.315 -0.865 . . . . 0.0 111.154 -179.358 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.511 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 40.1 t80 -64.9 -40.35 94.95 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.004 -1.06 . . . . 0.0 110.458 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.18 -23.53 60.44 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.141 -0.975 . . . . 0.0 110.584 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.535 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 10.2 m-30 -66.37 -28.05 68.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.147 -0.971 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 mmtt -63.62 -42.21 98.21 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 110.185 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -75.18 -40.41 59.44 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 110.313 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -95.05 39.78 1.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.192 -0.943 . . . . 0.0 110.405 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.473 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 9.4 p -57.62 -14.83 5.97 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.335 -0.853 . . . . 0.0 110.361 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 29.9 p -96.65 3.91 52.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.219 -0.925 . . . . 0.0 110.303 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 mp -92.25 -23.17 19.41 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.236 -0.915 . . . . 0.0 110.364 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.473 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 39.9 p90 -129.6 -177.0 4.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.203 -0.936 . . . . 0.0 109.783 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -95.33 -64.55 1.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.065 -1.022 . . . . 0.0 110.294 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.58 145.2 18.67 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 120.905 -1.122 . . . . 0.0 109.004 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.429 HG11 ' O ' ' B' ' 31' ' ' VAL . 7.7 p -91.77 102.66 13.75 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.74 -0.6 . . . . 0.0 110.471 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.462 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 2.6 p -51.87 154.2 2.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.053 -1.029 . . . . 0.0 109.835 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 2.9 p -60.76 158.82 12.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.015 -1.053 . . . . 0.0 109.898 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.71 126.63 30.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.491 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 33.4 p-90 -146.45 173.2 12.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.26 -0.9 . . . . 0.0 110.022 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.491 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 5.0 t60 -162.66 -178.45 6.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.149 -0.97 . . . . 0.0 110.655 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.509 ' CH2' ' OG1' ' A' ' 52' ' ' THR . 55.0 m95 -79.33 92.97 5.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.444 -0.785 . . . . 0.0 110.076 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' THR . . . . . 0.454 ' HB ' HG11 ' B' ' 42' ' ' VAL . 70.7 p -127.58 -142.49 0.27 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 110.256 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -168.09 -51.48 0.03 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -161.09 -61.09 0.06 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -1.105 . . . . 0.0 110.019 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -79.0 108.14 12.26 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.388 -0.82 . . . . 0.0 109.991 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.454 HG11 ' HB ' ' B' ' 38' ' ' THR . 0.1 OUTLIER -130.99 135.17 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.209 -0.932 . . . . 0.0 110.175 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.499 ' HD3' ' CG ' ' B' ' 44' ' ' HIS . 4.4 tttt -150.1 -39.89 0.14 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.29 -0.881 . . . . 0.0 110.134 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . 0.594 ' CD2' ' O ' ' B' ' 44' ' ' HIS . 0.5 OUTLIER -146.27 95.34 2.6 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.154 -0.966 . . . . 0.0 110.495 179.77 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -138.51 177.1 8.14 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.176 -0.952 . . . . 0.0 110.065 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.545 ' O ' HG13 ' B' ' 48' ' ' ILE . 0.1 OUTLIER -82.86 73.06 9.92 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.269 -0.894 . . . . 0.0 110.405 -179.819 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -45.08 154.9 0.13 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.423 -0.798 . . . . 0.0 110.586 -179.591 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.545 HG13 ' O ' ' B' ' 46' ' ' SER . 56.4 mt -145.99 150.05 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.348 -0.845 . . . . 0.0 110.376 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . 0.505 ' N ' HG22 ' B' ' 48' ' ' ILE . 2.1 t -122.79 170.13 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.216 -0.927 . . . . 0.0 109.857 179.576 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.492 HG23 ' N ' ' B' ' 51' ' ' LEU . 73.3 m -145.46 156.53 43.8 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.158 -0.964 . . . . 0.0 110.14 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.492 ' N ' HG23 ' B' ' 50' ' ' THR . 2.3 mp -136.23 133.65 37.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.889 . . . . 0.0 110.197 180.0 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 19.8 m -96.97 130.65 44.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.313 -0.867 . . . . 0.0 110.192 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.526 ' N ' ' CD1' ' B' ' 53' ' ' TYR . 16.3 m-85 -110.06 147.53 33.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.176 -0.953 . . . . 0.0 110.03 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -78.9 -2.95 42.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.727 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.52 139.04 1.21 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.151 -0.968 . . . . 0.0 110.162 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -56.22 -32.31 64.31 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.284 -0.885 . . . . 0.0 109.809 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 17.1 t-105 -54.7 -59.81 4.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 110.612 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.16 -36.73 71.11 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 111.065 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 48.5 ttp85 -59.16 -41.12 87.62 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.937 -1.102 . . . . 0.0 110.627 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.28 -41.25 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.117 -0.99 . . . . 0.0 110.672 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -65.46 -39.78 92.43 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.165 -0.959 . . . . 0.0 110.56 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . . . . . . . . . 10.1 t80 -55.59 -45.96 77.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.141 -0.974 . . . . 0.0 109.624 179.74 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.4 mt -59.72 -15.07 17.13 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.453 -0.78 . . . . 0.0 110.459 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -22.95 18.09 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.068 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -95.02 -26.6 16.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.267 -0.896 . . . . 0.0 109.886 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.507 ' O ' HG13 ' B' ' 68' ' ' ILE . 89.8 t -107.17 75.55 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.229 -0.919 . . . . 0.0 110.106 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 104.79 0.51 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.186 -0.946 . . . . 0.0 109.936 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.507 HG13 ' O ' ' B' ' 66' ' ' VAL . 0.8 OUTLIER -88.62 135.1 32.79 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.287 -0.883 . . . . 0.0 109.834 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.478 ' O ' ' O ' ' B' ' 68' ' ' ILE . 43.7 Cg_endo -54.76 -160.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.052 1.554 . . . . 0.0 110.706 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.453 ' HG2' ' O ' ' B' ' 70' ' ' LYS . 29.7 tttm -94.66 2.6 55.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.193 -0.942 . . . . 0.0 110.837 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' THR . . . . . 0.476 ' OG1' HG22 ' B' ' 13' ' ' THR . 4.6 p -85.32 -28.64 25.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.12 -0.988 . . . . 0.0 110.972 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.487 ' HB ' ' CG2' ' B' ' 68' ' ' ILE . 12.8 mm -94.32 124.36 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.143 -0.973 . . . . 0.0 111.035 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' THR . . . . . 0.476 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.3 t -96.18 138.54 33.64 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.001 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -89.87 166.25 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.067 -1.021 . . . . 0.0 111.053 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' SER . . . . . 0.5 ' HB2' ' O ' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -142.67 155.29 44.89 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.647 -0.658 . . . . 0.0 110.427 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.2 p -133.3 134.26 43.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.07 -170.14 26.4 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.585 ' CE2' ' HB2' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.86 150.24 33.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.234 -1.156 . . . . 0.0 110.129 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.403 ' O ' ' HB3' ' B' ' 1' ' ' MET . 24.5 mtp -122.18 157.76 30.86 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.901 . . . . 0.0 110.344 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.485 ' O ' HG13 ' B' ' 81' ' ' ILE . 0.2 OUTLIER -144.41 112.21 6.23 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.26 -0.9 . . . . 0.0 109.921 179.812 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.485 HG13 ' O ' ' B' ' 80' ' ' SER . 3.0 mp . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.122 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.207 0.527 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.9 p -125.11 109.85 27.15 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.296 -0.877 . . . . 0.0 110.106 179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.457 ' O ' HG23 ' A' ' 4' ' ' ILE . 44.4 Cg_endo -50.75 149.48 14.09 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.003 1.528 . . . . 0.0 110.364 179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 77' ' ' GLY . 1.0 OUTLIER -143.49 175.84 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.786 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.498 HG11 HG13 ' A' ' 74' ' ' VAL . 78.4 t -145.68 121.11 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.173 -0.955 . . . . 0.0 110.168 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.575 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 0.0 OUTLIER -105.39 125.72 51.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.243 -0.911 . . . . 0.0 110.333 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.47 ' HG ' HG13 ' A' ' 74' ' ' VAL . 3.3 mp -117.65 141.38 48.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.275 -0.89 . . . . 0.0 110.072 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.536 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 20.5 tptp -139.09 160.44 39.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.968 . . . . 0.0 110.455 -179.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.536 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 156.75 -156.76 27.43 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . 0.471 ' OD1' ' HB2' ' A' ' 12' ' ' ASN . 6.9 t70 -65.14 124.93 23.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.306 -1.114 . . . . 0.0 110.452 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.16 -36.09 28.77 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.261 -0.9 . . . . 0.0 110.388 179.877 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.471 ' HB2' ' OD1' ' A' ' 10' ' ' ASP . 3.9 m-20 -69.2 -46.83 66.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.162 -0.961 . . . . 0.0 110.682 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 54.9 m -57.69 -24.05 54.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.148 -0.97 . . . . 0.0 110.298 -179.8 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.461 ' HA ' ' CD1' ' A' ' 17' ' ' LEU . 51.9 mt -69.06 -32.36 71.76 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.415 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -59.59 -38.24 80.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 110.373 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 5.8 t -70.08 -36.64 75.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.158 -0.964 . . . . 0.0 110.506 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.461 ' CD1' ' HA ' ' A' ' 14' ' ' LEU . 31.6 mt -58.6 -50.9 72.13 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.239 -0.913 . . . . 0.0 110.308 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.559 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 11.0 ttm180 -46.4 -27.21 1.0 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.147 -0.971 . . . . 0.0 110.548 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.456 ' C ' ' CD1' ' A' ' 19' ' ' TYR . 9.5 t80 -64.93 -42.08 94.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.141 -0.974 . . . . 0.0 110.612 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.55 ' O ' ' CD2' ' A' ' 24' ' ' HIS . 74.1 mtt180 -72.13 -22.4 61.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.086 -1.009 . . . . 0.0 110.447 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.559 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 12.8 m-30 -66.58 -9.85 39.52 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.131 -0.981 . . . . 0.0 110.275 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -63.59 -50.92 67.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.257 -0.902 . . . . 0.0 110.536 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -75.14 -14.75 60.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.121 -0.987 . . . . 0.0 110.313 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.565 ' N ' ' CD2' ' A' ' 24' ' ' HIS . 7.1 m-70 -94.92 19.89 9.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.183 -0.948 . . . . 0.0 110.221 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.473 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 24.5 p -56.83 -24.76 53.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 0.0 110.052 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.5 t -97.08 3.48 51.75 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 110.161 179.9 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.502 HD13 ' CG ' ' A' ' 24' ' ' HIS . 23.9 mt -92.13 -32.49 15.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.507 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.473 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 50.8 p90 -117.6 167.53 11.24 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.039 -1.038 . . . . 0.0 109.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.8 m -100.26 -31.09 11.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.185 -0.947 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.93 117.03 2.56 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.104 -0.998 . . . . 0.0 110.792 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.465 ' O ' HG12 ' A' ' 31' ' ' VAL . 3.0 p -89.04 114.71 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.211 -0.931 . . . . 0.0 110.146 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.568 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 88.5 p -68.18 143.31 55.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.467 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 2.2 p -61.41 162.06 8.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.284 -0.885 . . . . 0.0 110.128 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 91.3 m -67.96 134.57 50.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.224 -0.922 . . . . 0.0 110.098 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.534 ' O ' ' N ' ' A' ' 48' ' ' ILE . 41.9 p-90 -146.52 -179.21 6.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.141 -0.975 . . . . 0.0 109.921 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.607 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 46.1 t60 -162.52 174.32 12.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.992 . . . . 0.0 110.417 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.607 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 89.0 m95 -78.43 105.39 9.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.87 . . . . 0.0 110.185 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.543 ' CG2' HG12 ' A' ' 42' ' ' VAL . 46.3 m -138.54 150.86 46.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.41 -0.806 . . . . 0.0 110.109 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.52 ' N ' HG21 ' A' ' 38' ' ' THR . . . -163.78 163.46 35.81 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.1 m170 54.94 -153.45 0.32 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.276 -1.132 . . . . 0.0 110.234 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -80.83 108.61 14.64 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.253 -0.905 . . . . 0.0 110.243 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.543 HG12 ' CG2' ' A' ' 38' ' ' THR . 5.0 p -177.02 153.69 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.264 -0.898 . . . . 0.0 109.88 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.42 ' N ' HG23 ' A' ' 42' ' ' VAL . 18.9 mtpt -103.91 159.62 15.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.083 -1.01 . . . . 0.0 110.65 -179.642 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.59 ' NE2' ' CB ' ' A' ' 47' ' ' ALA . 4.8 t-80 -50.26 164.69 0.11 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.39 -0.819 . . . . 0.0 110.275 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.491 ' N ' ' CG ' ' A' ' 44' ' ' HIS . 0.3 OUTLIER -155.38 -79.17 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.177 -0.952 . . . . 0.0 110.547 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.503 ' HB2' ' ND1' ' A' ' 36' ' ' HIS . 0.9 OUTLIER -83.78 70.09 10.31 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.206 -0.934 . . . . 0.0 110.454 -179.632 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.59 ' CB ' ' NE2' ' A' ' 44' ' ' HIS . . . -46.24 143.01 2.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.335 -0.853 . . . . 0.0 110.509 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.534 ' N ' ' O ' ' A' ' 35' ' ' TRP . 45.5 mt -142.93 134.3 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.364 -0.835 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 62.0 t -106.92 161.2 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.575 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 22.4 m -145.82 160.15 42.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.296 -0.877 . . . . 0.0 109.885 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.2 134.85 38.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.178 -0.951 . . . . 0.0 110.266 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.24 128.35 43.08 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 110.423 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.449 ' OH ' ' CD2' ' A' ' 62' ' ' PHE . 61.5 m-85 -118.42 151.01 38.59 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.308 -0.87 . . . . 0.0 110.228 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -103.72 -16.67 15.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.217 -0.927 . . . . 0.0 110.341 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.3 m -128.61 131.53 48.13 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 0.0 110.125 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -57.44 -50.04 74.31 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.237 -0.915 . . . . 0.0 110.347 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.65 -43.71 69.02 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.187 -0.945 . . . . 0.0 110.429 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -57.79 -44.91 86.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.313 -0.867 . . . . 0.0 110.589 -179.302 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.408 ' HD2' ' CG2' ' A' ' 5' ' ' VAL . 4.9 ttt-85 -58.79 -40.45 84.06 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.041 -1.037 . . . . 0.0 110.039 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -61.42 -36.18 79.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.489 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 61.9 mt-30 -65.64 -44.85 85.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.297 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.578 ' CZ ' HG13 ' A' ' 66' ' ' VAL . 4.2 t80 -55.75 -46.16 77.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.279 -0.888 . . . . 0.0 110.598 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.44 -23.0 62.31 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.927 . . . . 0.0 110.747 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 59.9 p -93.01 -19.87 21.15 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.074 -1.017 . . . . 0.0 110.619 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.489 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 27.9 mt-30 -95.83 -8.6 33.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.154 -0.966 . . . . 0.0 110.173 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.578 HG13 ' CZ ' ' A' ' 62' ' ' PHE . 16.9 m -111.82 108.57 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 0.0 110.047 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -65.61 107.79 1.84 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 110.243 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.493 HG22 ' HD2' ' A' ' 69' ' ' PRO . 16.2 mm -88.96 128.36 52.33 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.218 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.55 ' CG ' ' CD1' ' A' ' 72' ' ' ILE . 43.4 Cg_endo -58.83 -155.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.948 1.499 . . . . 0.0 110.366 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.498 ' O ' ' HD3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -111.02 40.76 1.96 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -0.972 . . . . 0.0 110.554 -179.729 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.74 -15.64 0.12 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.266 -0.896 . . . . 0.0 111.663 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.55 ' CD1' ' CG ' ' A' ' 69' ' ' PRO . 19.1 mt -94.95 103.44 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 120.693 -1.255 . . . . 0.0 110.037 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.49 HG21 ' N ' ' A' ' 74' ' ' VAL . 61.6 m -95.85 163.9 12.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.289 -0.882 . . . . 0.0 109.969 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.498 HG13 HG11 ' A' ' 5' ' ' VAL . 21.3 t -143.11 130.09 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.056 -1.028 . . . . 0.0 111.651 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 177.43 4.9 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.293 0.568 . . . . 0.0 110.089 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.406 ' O ' ' O ' ' B' ' 80' ' ' SER . 0.7 OUTLIER -111.84 152.97 27.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.176 -0.952 . . . . 0.0 110.252 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.461 ' O ' HG13 ' A' ' 4' ' ' ILE . . . -158.87 168.7 35.04 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' B' ' 78' ' ' PHE . 70.9 m-85 -147.71 124.82 11.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.142 -1.211 . . . . 0.0 110.174 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.477 ' HE3' ' CE1' ' B' ' 6' ' ' HIS . 0.0 OUTLIER -98.3 174.24 6.59 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.223 -0.923 . . . . 0.0 110.384 -179.866 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.486 ' O ' ' O ' ' B' ' 76' ' ' THR . 0.0 OUTLIER -144.21 106.34 4.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.28 -0.888 . . . . 0.0 110.105 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.435 ' CG2' ' C ' ' A' ' 80' ' ' SER . 10.7 pt . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.266 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.185 0.517 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 24.4 p -125.74 108.59 25.65 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.178 -0.951 . . . . 0.0 110.323 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.459 ' O ' HG23 ' B' ' 4' ' ' ILE . 47.3 Cg_endo -49.3 150.04 8.33 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.06 1.558 . . . . 0.0 110.533 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.459 HG23 ' O ' ' B' ' 3' ' ' PRO . 1.0 OUTLIER -143.88 176.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 0.0 110.391 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.501 HG11 HG13 ' B' ' 74' ' ' VAL . 77.6 t -145.89 120.91 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.245 -0.909 . . . . 0.0 110.1 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.574 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 0.0 OUTLIER -105.59 125.54 51.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.475 HD21 HG21 ' B' ' 74' ' ' VAL . 3.1 mp -117.34 141.43 48.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.327 -0.858 . . . . 0.0 110.194 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.533 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 20.8 tptp -139.13 160.02 40.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.139 -0.976 . . . . 0.0 110.45 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.533 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 156.88 -156.6 27.31 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . 0.442 ' OD1' ' HB2' ' B' ' 12' ' ' ASN . 5.4 t70 -65.15 125.01 23.66 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.29 -1.124 . . . . 0.0 110.423 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.14 -36.8 31.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 110.47 179.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . 0.442 ' HB2' ' OD1' ' B' ' 10' ' ' ASP . 3.7 m-20 -68.35 -47.32 67.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.702 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 63.1 m -57.79 -23.04 50.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.151 -0.968 . . . . 0.0 110.247 -179.695 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.445 ' HA ' ' CD1' ' B' ' 17' ' ' LEU . 53.9 mt -69.65 -32.11 70.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.289 -0.882 . . . . 0.0 110.285 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -59.72 -38.75 82.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.249 -0.907 . . . . 0.0 110.419 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.414 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 6.8 t -70.04 -36.64 75.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.927 . . . . 0.0 110.459 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.445 ' CD1' ' HA ' ' B' ' 14' ' ' LEU . 30.2 mt -58.59 -50.7 72.86 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.134 -0.978 . . . . 0.0 110.3 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.552 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 10.9 ttm180 -46.5 -27.13 1.01 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.401 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.463 ' C ' ' CD1' ' B' ' 19' ' ' TYR . 9.1 t80 -64.99 -42.35 94.59 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.188 -0.945 . . . . 0.0 110.694 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . 0.549 ' O ' ' CD2' ' B' ' 24' ' ' HIS . 74.8 mtt180 -71.58 -22.63 61.71 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.165 -0.959 . . . . 0.0 110.402 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.552 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 12.7 m-30 -66.44 -9.9 38.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.142 -0.974 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.67 -50.87 67.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.237 -0.914 . . . . 0.0 110.434 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -75.07 -14.66 60.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.201 -0.937 . . . . 0.0 110.235 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.556 ' CD2' ' N ' ' B' ' 24' ' ' HIS . 7.8 m-70 -94.92 19.75 9.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.973 . . . . 0.0 110.186 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.469 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 25.4 p -57.08 -25.07 58.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 3.4 t -96.84 3.37 52.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.265 -0.897 . . . . 0.0 110.001 179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.47 HD13 ' CG ' ' B' ' 24' ' ' HIS . 23.9 mt -92.03 -32.61 15.13 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.288 -0.883 . . . . 0.0 110.501 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.469 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 50.6 p90 -117.64 167.17 11.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.004 -1.06 . . . . 0.0 110.129 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.9 m -100.07 -31.06 11.61 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 110.665 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 116.88 2.55 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.006 -1.059 . . . . 0.0 110.744 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.485 HG12 ' O ' ' B' ' 31' ' ' VAL . 3.1 p -89.1 112.88 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.182 -0.949 . . . . 0.0 110.073 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.503 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 91.1 p -66.43 142.95 57.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.367 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 1.5 p -61.32 162.11 8.19 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 89.6 m -68.0 134.81 51.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 110.207 -179.884 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.568 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 41.1 p-90 -146.36 -179.15 6.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.913 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.614 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 46.0 t60 -162.53 174.41 12.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.128 -0.982 . . . . 0.0 110.427 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.614 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 88.1 m95 -78.65 104.94 9.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.336 -0.853 . . . . 0.0 110.294 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' THR . . . . . 0.555 ' CG2' HG12 ' B' ' 42' ' ' VAL . 44.5 m -138.21 152.01 48.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.431 -0.793 . . . . 0.0 109.943 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . 0.53 ' N ' HG21 ' B' ' 38' ' ' THR . . . -164.91 163.08 36.17 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 19.6 m170 55.22 -153.35 0.33 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -1.118 . . . . 0.0 110.197 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 6.2 t-20 -80.79 108.44 14.45 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.188 -0.945 . . . . 0.0 110.189 -179.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.555 HG12 ' CG2' ' B' ' 38' ' ' THR . 5.5 p -176.95 153.86 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.248 -0.908 . . . . 0.0 109.958 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.414 ' N ' HG23 ' B' ' 42' ' ' VAL . 18.6 mtpt -104.12 159.21 15.87 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.206 -0.934 . . . . 0.0 110.652 -179.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . 0.594 ' NE2' ' CB ' ' B' ' 47' ' ' ALA . 5.0 t-80 -50.29 165.06 0.1 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.43 -0.794 . . . . 0.0 110.291 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . 0.487 ' N ' ' CG ' ' B' ' 44' ' ' HIS . 0.8 OUTLIER -155.78 -78.37 0.09 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.321 -0.862 . . . . 0.0 110.547 -179.97 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.511 ' HB2' ' ND1' ' B' ' 36' ' ' HIS . 0.9 OUTLIER -84.31 70.26 10.59 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.26 -0.9 . . . . 0.0 110.456 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.594 ' CB ' ' NE2' ' B' ' 44' ' ' HIS . . . -46.4 142.2 3.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.387 -0.821 . . . . 0.0 110.645 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.519 ' N ' ' O ' ' B' ' 35' ' ' TRP . 45.4 mt -142.59 134.85 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.289 -0.882 . . . . 0.0 110.025 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.64 161.22 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.157 -0.964 . . . . 0.0 110.522 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.574 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 23.6 m -145.88 160.32 41.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.805 . . . . 0.0 109.908 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.36 134.96 38.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.162 -0.962 . . . . 0.0 110.335 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 127.29 42.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.235 -0.915 . . . . 0.0 110.255 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.468 ' OH ' ' CD2' ' B' ' 62' ' ' PHE . 61.0 m-85 -117.11 150.81 38.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.349 -0.844 . . . . 0.0 109.982 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -103.49 -16.72 15.48 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 19.4 m -128.43 132.42 48.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.181 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -58.19 -49.89 75.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.885 . . . . 0.0 110.252 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.76 -43.52 69.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.342 -0.849 . . . . 0.0 110.527 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -57.85 -45.29 86.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.319 -0.863 . . . . 0.0 110.612 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.451 ' HD2' ' CG2' ' B' ' 5' ' ' VAL . 4.7 ttt-85 -58.83 -40.86 85.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.091 -1.005 . . . . 0.0 110.119 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -61.12 -35.79 77.99 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.862 . . . . 0.0 110.301 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.476 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 60.3 mt-30 -65.61 -45.21 84.0 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.243 -0.91 . . . . 0.0 110.391 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.577 ' CZ ' HG13 ' B' ' 66' ' ' VAL . 4.4 t80 -55.53 -46.2 77.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.314 -0.866 . . . . 0.0 110.703 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.57 -22.03 61.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.233 -0.917 . . . . 0.0 110.693 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 58.9 p -93.92 -19.82 20.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.247 -0.908 . . . . 0.0 110.574 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . 0.476 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 30.0 mt-30 -95.82 -9.58 31.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.21 -0.931 . . . . 0.0 110.066 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.577 HG13 ' CZ ' ' B' ' 62' ' ' PHE . 16.8 m -110.75 109.02 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.865 . . . . 0.0 110.155 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -66.31 107.96 2.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.347 -0.846 . . . . 0.0 110.266 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.483 HG22 ' HD2' ' B' ' 69' ' ' PRO . 17.1 mm -89.1 127.45 55.45 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.41 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.557 ' CG ' ' CD1' ' B' ' 72' ' ' ILE . 43.5 Cg_endo -57.46 -155.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 124.054 1.555 . . . . 0.0 110.442 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . 0.496 ' O ' ' HD3' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -112.15 40.84 2.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.025 -1.047 . . . . 0.0 110.458 -179.775 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.63 -15.7 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.295 -0.878 . . . . 0.0 111.616 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.557 ' CD1' ' CG ' ' B' ' 69' ' ' PRO . 20.7 mt -94.98 102.95 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 120.934 -1.104 . . . . 0.0 109.898 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' THR . . . . . 0.466 HG21 ' N ' ' B' ' 74' ' ' VAL . 66.0 m -95.45 163.71 13.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.883 . . . . 0.0 110.083 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.501 HG13 HG11 ' B' ' 5' ' ' VAL . 21.5 t -142.88 130.64 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.05 -1.031 . . . . 0.0 111.615 -178.593 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.97 178.7 4.54 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.144 179.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.7 OUTLIER -113.75 151.07 32.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 179.81 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . 0.454 ' O ' HG13 ' B' ' 4' ' ' ILE . . . -157.23 169.7 34.32 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' A' ' 78' ' ' PHE . 69.4 m-85 -147.85 126.57 12.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -1.153 . . . . 0.0 110.136 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.556 ' HE3' ' CE1' ' A' ' 6' ' ' HIS . 0.0 OUTLIER -100.57 172.59 7.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.093 -1.005 . . . . 0.0 110.297 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.435 ' C ' ' CG2' ' B' ' 81' ' ' ILE . 0.1 OUTLIER -142.48 107.06 4.82 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.897 . . . . 0.0 109.875 179.86 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.435 ' CG2' ' C ' ' B' ' 80' ' ' SER . 10.5 pt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.284 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.478 ' HB2' ' CE2' ' A' ' 78' ' ' PHE . 23.9 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' THR . . . . . 0.408 HG23 ' O ' ' A' ' 53' ' ' TYR . 52.1 m -128.04 133.17 24.84 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.294 -0.879 . . . . 0.0 109.913 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.509 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -81.5 161.7 19.51 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.925 1.487 . . . . 0.0 110.319 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.431 HG23 ' CG2' ' A' ' 52' ' ' THR . 6.5 pt -144.05 163.63 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.093 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.8 t -145.75 129.84 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.573 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.2 OUTLIER -105.37 137.0 43.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.267 -0.895 . . . . 0.0 110.374 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.482 ' O ' HG21 ' A' ' 48' ' ' ILE . 3.4 pp -125.38 142.78 51.31 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.343 -0.848 . . . . 0.0 109.826 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.514 ' O ' ' CD1' ' A' ' 72' ' ' ILE . 21.6 tptt -136.18 154.82 50.84 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.054 -1.028 . . . . 0.0 110.833 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.477 ' HA3' HD13 ' A' ' 72' ' ' ILE . . . 161.89 -178.74 37.63 Favored Glycine 0 N--CA 1.486 1.985 0 N-CA-C 108.455 -1.858 . . . . 0.0 108.455 -179.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.56 150.47 48.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.976 -1.308 . . . . 0.0 111.07 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . 0.509 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.83 -52.18 43.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.143 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -48.82 -45.55 40.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.11 -0.994 . . . . 0.0 110.16 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.2 m -58.03 -20.89 42.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.33 -0.856 . . . . 0.0 110.203 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.509 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 16.5 mt -83.93 -32.32 25.15 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.235 -0.915 . . . . 0.0 110.302 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -60.91 -37.04 80.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.075 -1.016 . . . . 0.0 110.488 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -47.77 59.27 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.268 -0.895 . . . . 0.0 111.384 -179.054 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.0 mt -58.44 -52.38 65.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.072 -1.017 . . . . 0.0 110.539 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 -45.66 -33.94 3.2 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -64.73 -13.13 53.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.233 -0.917 . . . . 0.0 110.163 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.22 -33.2 10.53 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.244 -0.91 . . . . 0.0 110.241 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.561 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 8.7 m-30 -66.59 -33.63 76.1 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.48 -44.83 93.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 110.383 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -75.03 -32.63 61.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.187 -0.946 . . . . 0.0 110.249 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.606 ' O ' ' N ' ' A' ' 26' ' ' THR . 28.6 m170 -95.78 34.65 1.48 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.322 -0.861 . . . . 0.0 110.34 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.576 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 13.2 p -59.6 43.53 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.435 -0.791 . . . . 0.0 112.011 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' THR . . . . . 0.606 ' N ' ' O ' ' A' ' 24' ' ' HIS . 75.3 p -144.72 33.29 1.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.768 -1.208 . . . . 0.0 109.663 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 78.6 mt -146.31 -5.79 0.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.183 -0.948 . . . . 0.0 111.448 -179.331 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.576 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 10.5 p90 -126.13 162.38 25.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.686 -1.259 . . . . 0.0 108.912 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.483 ' HB ' ' O ' ' A' ' 52' ' ' THR . 6.6 m -101.81 -38.74 7.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.641 -1.287 . . . . 0.0 111.34 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.01 120.08 2.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.881 -1.137 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.442 ' O ' HG22 ' B' ' 38' ' ' THR . 3.2 p -88.97 105.65 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.281 -0.887 . . . . 0.0 109.893 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.582 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 54.7 p -64.35 152.87 40.14 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.528 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.46 155.56 21.49 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.278 -0.888 . . . . 0.0 110.109 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' THR . . . . . 0.429 ' HA ' HG22 ' A' ' 49' ' ' VAL . 31.9 m -68.05 129.18 39.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.223 -0.923 . . . . 0.0 110.546 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 50.5 p-90 -147.13 179.92 7.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.207 -0.933 . . . . 0.0 110.125 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.549 ' CG ' ' HA ' ' A' ' 46' ' ' SER . 36.2 t-80 -162.57 173.27 14.19 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.977 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.539 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 98.1 m95 -79.07 126.0 30.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.13 -0.981 . . . . 0.0 109.928 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.4 t -107.85 152.8 23.91 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -170.24 175.88 44.07 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -63.02 -27.78 69.65 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -1.134 . . . . 0.0 110.237 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -125.44 101.72 7.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.249 -0.907 . . . . 0.0 110.124 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.0 m -115.18 176.67 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.292 -0.88 . . . . 0.0 110.151 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.0 pttt -131.97 -175.33 3.7 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.282 -0.886 . . . . 0.0 110.145 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -51.9 -54.97 23.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.324 -0.86 . . . . 0.0 110.255 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . 0.437 ' HE2' ' HE2' ' A' ' 8' ' ' LYS . 13.5 mtpt -52.52 114.51 1.4 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.261 -0.899 . . . . 0.0 110.321 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.549 ' HA ' ' CG ' ' A' ' 36' ' ' HIS . 1.8 t -160.98 66.23 0.3 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.192 -0.943 . . . . 0.0 110.288 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -169.36 115.23 0.57 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.276 -0.89 . . . . 0.0 110.189 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.522 ' N ' ' O ' ' A' ' 35' ' ' TRP . 68.7 mt -142.8 155.99 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.406 -0.809 . . . . 0.0 109.854 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.512 ' N ' HG23 ' A' ' 48' ' ' ILE . 87.2 t -136.24 129.79 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.144 -0.972 . . . . 0.0 110.524 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.493 ' OG1' ' NE2' ' A' ' 6' ' ' HIS . 86.5 m -93.94 150.06 20.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.071 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -135.05 121.18 20.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.103 -0.998 . . . . 0.0 110.055 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.483 ' O ' ' HB ' ' A' ' 29' ' ' THR . 0.0 OUTLIER -99.0 144.26 28.36 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 110.408 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.509 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 26.4 m-85 -124.08 156.73 36.07 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 109.839 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -83.67 -6.03 59.34 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.149 -0.97 . . . . 0.0 110.682 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.1 m -163.98 156.4 17.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.092 -1.005 . . . . 0.0 110.408 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.403 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 62.9 mt-10 -68.62 -41.25 79.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.258 -0.901 . . . . 0.0 110.28 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.411 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 6.0 t90 -53.64 -52.75 58.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.179 -0.95 . . . . 0.0 109.982 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.461 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 48.1 tt0 -58.98 -32.86 70.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.384 -0.823 . . . . 0.0 110.253 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.403 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 3.6 ttm180 -59.02 -54.52 46.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.302 -0.874 . . . . 0.0 110.621 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -61.04 -25.87 67.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.193 -0.942 . . . . 0.0 110.32 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.461 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 68.4 mt-30 -65.63 -54.36 28.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.159 -0.963 . . . . 0.0 110.308 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.482 ' CE2' HG22 ' A' ' 66' ' ' VAL . 7.2 t80 -55.76 -46.75 77.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.343 -0.848 . . . . 0.0 110.456 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.4 mt -59.14 -20.64 55.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.281 -0.887 . . . . 0.0 110.343 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.44 -22.54 19.56 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.904 . . . . 0.0 110.289 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -96.41 -21.56 17.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.2 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.482 HG22 ' CE2' ' A' ' 62' ' ' PHE . 59.9 t -97.55 105.55 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.47 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . 0.422 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.7 OUTLIER -58.26 103.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.899 179.664 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.439 HG23 ' CG2' ' A' ' 72' ' ' ILE . 40.6 mt -88.9 99.51 1.57 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 110.094 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.406 ' HG2' HG12 ' A' ' 72' ' ' ILE . 46.8 Cg_endo -45.13 159.41 0.15 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.069 1.563 . . . . 0.0 110.36 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -63.82 -13.68 46.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.5 p -84.62 -21.11 30.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.268 -0.895 . . . . 0.0 110.195 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.514 ' CD1' ' O ' ' A' ' 8' ' ' LYS . 6.8 mm -94.24 113.47 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.0 110.183 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.5 m -94.35 145.06 25.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.252 -0.905 . . . . 0.0 110.174 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.51 171.8 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.204 -0.935 . . . . 0.0 110.921 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' SER . . . . . 0.573 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.6 OUTLIER -142.68 154.65 44.52 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.576 -0.703 . . . . 0.0 110.496 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 60.4 p -131.77 134.89 46.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.174 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.34 -170.7 34.2 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' B' ' 78' ' ' PHE . 0.0 OUTLIER -147.71 143.91 27.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.362 -1.081 . . . . 0.0 110.033 -179.934 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.2 mmm -135.89 155.42 50.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.779 -1.201 . . . . 0.0 110.649 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.81 108.56 5.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 0.0 110.065 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.3 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.216 -179.972 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.492 ' HB2' ' CE2' ' B' ' 78' ' ' PHE . 22.5 mtp . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.205 0.526 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.441 HG23 ' O ' ' B' ' 53' ' ' TYR . 58.8 m -127.31 133.84 25.51 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.382 -0.824 . . . . 0.0 110.154 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.507 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -82.19 161.2 17.82 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.918 1.483 . . . . 0.0 110.287 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.413 HG23 ' CG2' ' B' ' 52' ' ' THR . 6.4 pt -143.99 163.36 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.242 -0.911 . . . . 0.0 110.096 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -145.78 130.89 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.237 -0.915 . . . . 0.0 110.267 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.568 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.2 OUTLIER -106.1 138.91 41.45 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.244 -0.91 . . . . 0.0 110.349 -179.943 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.475 ' O ' HG21 ' B' ' 48' ' ' ILE . 3.5 pp -127.96 142.9 51.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.195 -0.941 . . . . 0.0 110.299 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.533 ' O ' ' CD1' ' B' ' 72' ' ' ILE . 24.1 tptt -140.21 163.17 33.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.118 -0.989 . . . . 0.0 110.526 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.523 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 166.16 -79.7 0.12 Allowed Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -173.28 150.7 1.92 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.252 -1.146 . . . . 0.0 109.509 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . 0.468 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -49.39 -57.3 7.17 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 110.645 -179.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -50.65 -48.51 58.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.408 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 69.8 m -58.19 -21.99 49.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.171 -0.956 . . . . 0.0 110.484 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.468 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 16.3 mt -83.34 -32.83 26.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -0.977 . . . . 0.0 110.603 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 ttmt -60.81 -36.98 80.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.016 -1.053 . . . . 0.0 110.635 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -47.5 61.98 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.232 -0.917 . . . . 0.0 111.181 -179.191 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.3 mt -58.54 -52.7 64.53 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.104 -0.998 . . . . 0.0 110.664 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -45.28 -33.69 2.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.232 -0.917 . . . . 0.0 110.135 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -64.82 -13.64 56.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.269 -0.895 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.48 -33.4 10.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.169 -0.957 . . . . 0.0 110.172 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.1 m-30 -66.49 -33.91 76.74 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.23 -0.919 . . . . 0.0 110.355 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.42 -44.7 93.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.343 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 mmtm -74.97 -32.93 61.81 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.184 -0.947 . . . . 0.0 110.26 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.602 ' O ' ' N ' ' B' ' 26' ' ' THR . 28.8 m170 -95.48 35.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.281 -0.887 . . . . 0.0 110.238 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.586 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.3 p -59.78 43.07 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.467 -0.771 . . . . 0.0 112.139 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' THR . . . . . 0.602 ' N ' ' O ' ' B' ' 24' ' ' HIS . 77.8 p -144.69 33.84 1.15 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.729 -1.232 . . . . 0.0 109.846 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.417 ' HG ' ' C ' ' B' ' 26' ' ' THR . 81.5 mt -146.5 -6.04 0.55 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.237 -0.914 . . . . 0.0 111.375 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.586 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 10.9 p90 -125.42 162.61 24.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.701 -1.249 . . . . 0.0 108.779 178.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.489 ' HB ' ' O ' ' B' ' 52' ' ' THR . 6.9 m -101.77 -39.01 7.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.642 -1.286 . . . . 0.0 111.187 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.97 120.18 2.97 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.059 -1.025 . . . . 0.0 111.185 -179.523 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.414 HG12 ' O ' ' B' ' 31' ' ' VAL . 3.3 p -89.09 105.26 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.006 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.58 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.3 p -64.39 153.05 39.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.252 -0.905 . . . . 0.0 110.557 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.22 155.98 19.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.272 -0.892 . . . . 0.0 110.42 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' THR . . . . . 0.453 ' HA ' HG22 ' B' ' 49' ' ' VAL . 26.8 m -68.17 128.48 36.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.382 -0.824 . . . . 0.0 110.343 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.582 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 49.7 p-90 -146.94 179.51 7.54 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.548 ' CG ' ' HA ' ' B' ' 46' ' ' SER . 36.4 t-80 -162.28 173.3 14.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.081 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.536 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 98.0 m95 -79.18 125.19 29.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 0.0 110.009 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' THR . . . . . 0.442 HG22 ' O ' ' A' ' 31' ' ' VAL . 11.3 t -107.22 152.62 23.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.234 -0.916 . . . . 0.0 110.157 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -169.51 177.15 43.22 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -64.5 -27.22 68.83 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.276 -1.132 . . . . 0.0 110.147 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -125.68 102.07 7.17 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.238 -0.914 . . . . 0.0 110.193 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 20.0 m -115.72 176.42 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 110.121 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 6.2 pttt -131.12 -174.69 3.46 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.248 -0.908 . . . . 0.0 110.21 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -52.24 -54.42 31.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.237 -0.914 . . . . 0.0 110.236 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . 0.452 ' HE2' ' HE2' ' B' ' 8' ' ' LYS . 13.1 mtpt -53.26 115.38 1.87 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.265 -0.897 . . . . 0.0 110.252 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.548 ' HA ' ' CG ' ' B' ' 36' ' ' HIS . 1.8 t -161.37 65.87 0.28 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 109.989 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -169.05 115.1 0.59 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.335 -0.853 . . . . 0.0 110.327 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.517 ' N ' ' O ' ' B' ' 35' ' ' TRP . 62.8 mt -143.1 156.13 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.32 -0.862 . . . . 0.0 109.987 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . 0.482 ' N ' HG23 ' B' ' 48' ' ' ILE . 76.2 t -136.25 129.84 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 110.537 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.527 ' OG1' ' NE2' ' B' ' 6' ' ' HIS . 87.1 m -94.01 149.78 20.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.367 -0.833 . . . . 0.0 109.873 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -134.69 121.56 20.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.043 -1.036 . . . . 0.0 110.052 -179.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.489 ' O ' ' HB ' ' B' ' 29' ' ' THR . 0.0 OUTLIER -99.22 144.57 28.2 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.313 -0.867 . . . . 0.0 110.607 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.507 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 26.0 m-85 -124.62 157.09 36.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.268 -0.895 . . . . 0.0 109.893 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -84.0 -6.99 59.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.264 -0.898 . . . . 0.0 110.664 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.57 157.81 22.57 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.101 -0.999 . . . . 0.0 110.354 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . 0.401 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 57.9 mt-10 -70.16 -41.11 74.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.234 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . 0.408 ' O ' ' HG3' ' B' ' 61' ' ' GLN . 6.0 t90 -53.56 -52.55 59.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.093 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.453 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 46.5 tt0 -59.28 -32.55 70.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.855 . . . . 0.0 110.233 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.401 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 3.7 ttm180 -59.11 -54.38 47.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.228 -0.92 . . . . 0.0 110.448 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.15 -26.07 67.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.217 -0.927 . . . . 0.0 110.324 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.453 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 68.0 mt-30 -65.55 -54.28 30.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.207 -0.933 . . . . 0.0 110.229 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.484 ' C ' ' CD1' ' B' ' 62' ' ' PHE . 7.1 t80 -55.91 -46.69 78.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.318 -0.864 . . . . 0.0 110.518 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.4 mt -59.31 -20.71 56.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.55 -22.3 19.6 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.228 -0.92 . . . . 0.0 110.368 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -96.33 -22.0 17.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.22 -0.925 . . . . 0.0 110.023 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.401 HG22 ' CE2' ' B' ' 62' ' ' PHE . 60.7 t -97.22 107.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.341 -0.849 . . . . 0.0 110.341 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.28 103.22 0.22 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -0.885 . . . . 0.0 109.855 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.461 HG23 ' CG2' ' B' ' 72' ' ' ILE . 40.1 mt -88.68 98.68 1.17 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.244 -0.91 . . . . 0.0 110.264 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.441 ' HG2' HG12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -43.99 159.45 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.998 1.525 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 20.9 mtmt -63.73 -13.84 47.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.22 -0.925 . . . . 0.0 110.263 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.3 p -84.64 -20.94 30.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 0.0 110.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.533 ' CD1' ' O ' ' B' ' 8' ' ' LYS . 6.8 mm -93.75 113.22 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 0.0 110.108 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.1 m -94.3 144.96 25.09 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.305 -0.872 . . . . 0.0 110.091 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.54 171.57 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 110.973 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' SER . . . . . 0.568 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -142.93 154.0 43.63 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.613 -0.68 . . . . 0.0 110.516 179.825 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 60.9 p -131.43 135.72 47.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.293 -0.88 . . . . 0.0 110.146 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.47 -170.89 34.54 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' A' ' 78' ' ' PHE . 0.0 OUTLIER -147.69 143.64 27.77 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.253 -1.145 . . . . 0.0 109.964 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.4 mmm -135.7 155.64 50.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.951 -1.093 . . . . 0.0 110.742 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -142.33 109.27 5.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.383 -0.823 . . . . 0.0 109.982 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.216 -179.907 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.441 ' CE ' ' HB3' ' A' ' 78' ' ' PHE . 3.5 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.297 0.57 . . . . 0.0 110.307 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.39 108.67 61.95 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.275 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 51.9 Cg_endo -68.68 143.3 55.84 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.019 1.536 . . . . 0.0 110.047 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.49 ' O ' HG11 ' A' ' 5' ' ' VAL . 3.0 pt -144.69 164.75 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.142 -0.974 . . . . 0.0 110.778 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.49 HG11 ' O ' ' A' ' 4' ' ' ILE . 17.1 m -144.54 147.05 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.724 . . . . 0.0 109.497 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.568 ' CD2' ' HE3' ' B' ' 79' ' ' MET . 0.3 OUTLIER -105.71 127.91 53.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.047 -1.033 . . . . 0.0 110.687 -179.66 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.479 ' O ' ' CG2' ' A' ' 48' ' ' ILE . 0.2 OUTLIER -116.78 136.0 53.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.519 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 13.4 ttmt -140.12 164.47 29.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.221 -0.924 . . . . 0.0 110.26 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 152.49 -174.95 31.29 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.89 136.9 57.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.25 -1.147 . . . . 0.0 110.088 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.97 -23.31 1.94 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 110.136 -179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -68.95 -59.84 2.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.22 -0.925 . . . . 0.0 110.304 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.43 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -57.96 -21.67 45.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.324 -0.86 . . . . 0.0 110.21 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 17.9 mt -66.8 -45.57 77.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.303 -0.873 . . . . 0.0 110.443 -179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -59.93 -31.26 69.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.186 -0.947 . . . . 0.0 110.373 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.1 t -69.94 -41.75 74.15 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.237 -0.914 . . . . 0.0 110.545 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.43 ' HG ' ' O ' ' A' ' 13' ' ' THR . 82.3 mt -58.96 -52.48 65.58 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.118 -0.989 . . . . 0.0 110.435 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.492 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 24.3 ttt-85 -48.89 -24.35 1.44 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.299 -0.875 . . . . 0.0 110.525 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.49 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 9.8 t80 -64.54 -40.67 96.03 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.106 -0.996 . . . . 0.0 110.282 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 mtm-85 -76.17 -15.53 60.04 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.173 -0.955 . . . . 0.0 110.029 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.492 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 3.7 m-30 -66.33 -30.9 71.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.251 -0.905 . . . . 0.0 109.836 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -63.31 -33.96 76.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -0.915 . . . . 0.0 109.883 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -74.89 -48.91 22.33 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.85 . . . . 0.0 109.732 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.494 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 54.4 m-70 -95.27 28.51 2.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.333 -0.855 . . . . 0.0 109.761 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.597 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 22.6 p -56.75 -22.02 32.53 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 110.027 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 23.0 p -97.22 10.94 38.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -0.853 . . . . 0.0 109.949 179.785 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.494 ' HB2' ' O ' ' A' ' 24' ' ' HIS . 0.7 OUTLIER -92.1 -43.37 9.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.0 110.175 179.903 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.597 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 19.8 p90 -96.41 175.72 6.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.1 -1.0 . . . . 0.0 109.965 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.455 ' OG1' ' HB2' ' A' ' 54' ' ' ASP . 88.7 m -101.27 -34.44 9.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.081 -1.012 . . . . 0.0 111.349 -179.285 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.65 118.88 2.52 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.953 -1.092 . . . . 0.0 110.969 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.578 HG11 ' CE1' ' A' ' 28' ' ' TYR . 7.4 m -89.39 100.0 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.973 -1.08 . . . . 0.0 109.623 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.557 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 58.0 p -47.55 144.34 3.17 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.302 -0.874 . . . . 0.0 110.771 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.1 p -61.86 164.92 5.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.228 -0.92 . . . . 0.0 109.948 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.9 m -68.03 120.5 14.36 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.117 -0.99 . . . . 0.0 110.142 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.491 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 32.7 p-90 -146.52 -174.02 4.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 109.64 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.559 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 28.2 t-80 -162.78 171.51 16.64 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.861 -1.149 . . . . 0.0 111.117 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.559 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 22.0 m95 -78.74 93.76 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.472 -0.767 . . . . 0.0 110.151 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.469 ' O ' ' O ' ' B' ' 31' ' ' VAL . 4.0 t -175.1 163.89 3.24 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . 0.467 ' O ' ' HA ' ' B' ' 33' ' ' SER . . . -59.48 -114.92 0.01 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -128.65 -12.32 4.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.196 -1.179 . . . . 0.0 110.616 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.479 ' O ' HG12 ' A' ' 42' ' ' VAL . 3.0 t-20 -141.01 127.41 19.87 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.123 -0.986 . . . . 0.0 110.385 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.479 HG12 ' O ' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -159.32 159.93 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.338 -0.851 . . . . 0.0 110.056 179.83 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -98.48 -27.6 13.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.27 -0.894 . . . . 0.0 110.463 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -57.55 167.8 0.96 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.129 -0.982 . . . . 0.0 110.399 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -125.57 122.48 36.63 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.286 -0.884 . . . . 0.0 110.026 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.512 ' O ' HG13 ' A' ' 48' ' ' ILE . 5.5 p -164.94 34.33 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.029 -1.044 . . . . 0.0 110.682 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.07 142.73 3.46 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.284 -0.885 . . . . 0.0 110.51 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.55 HG23 ' N ' ' A' ' 49' ' ' VAL . 63.3 mt -141.89 149.65 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.37 -0.831 . . . . 0.0 110.153 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . 0.55 ' N ' HG23 ' A' ' 48' ' ' ILE . 40.4 t -120.2 121.32 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.275 -0.891 . . . . 0.0 110.814 -179.55 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.469 ' HB ' ' OG ' ' A' ' 32' ' ' SER . 33.2 m -93.73 148.95 21.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.329 -0.857 . . . . 0.0 109.131 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.482 HD23 ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -135.04 122.61 22.05 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.921 -1.112 . . . . 0.0 110.789 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.48 ' HA ' ' O ' ' A' ' 3' ' ' PRO . 26.1 m -98.12 144.26 27.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.547 -0.721 . . . . 0.0 109.416 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.501 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 55.2 m-85 -120.77 155.86 33.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.037 -1.039 . . . . 0.0 110.659 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . 0.455 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 2.9 t70 -78.16 -9.39 59.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 110.832 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 56' ' ' GLU . 3.0 m -163.3 127.67 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.053 -1.029 . . . . 0.0 110.341 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -45.28 -41.76 8.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.218 -0.926 . . . . 0.0 109.834 179.666 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . 0.463 ' HA ' ' CE3' ' A' ' 57' ' ' TRP . 6.1 t-105 -54.05 -51.03 65.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.367 -0.833 . . . . 0.0 110.077 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.43 ' HA ' ' NE2' ' A' ' 61' ' ' GLN . 4.3 tp60 -58.35 -37.78 75.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.266 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.4 ttp85 -59.14 -44.31 92.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.194 -0.941 . . . . 0.0 110.674 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -36.85 80.9 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.158 -0.964 . . . . 0.0 110.16 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.43 ' NE2' ' HA ' ' A' ' 58' ' ' GLN . 37.8 mt-30 -65.68 -41.19 92.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.161 -0.962 . . . . 0.0 110.388 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.465 ' CE1' HG22 ' A' ' 66' ' ' VAL . 23.5 t80 -55.96 -48.14 76.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.335 -0.853 . . . . 0.0 110.13 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.424 HD22 HG11 ' A' ' 74' ' ' VAL . 15.4 mt -59.09 -14.88 11.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.33 -0.857 . . . . 0.0 110.448 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.7 p -99.98 -21.46 15.64 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.7 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.422 ' OE1' HD21 ' A' ' 27' ' ' LEU . 31.6 mt-30 -94.13 -29.03 15.36 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.111 -0.993 . . . . 0.0 110.704 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.471 HG23 HG12 ' A' ' 68' ' ' ILE . 5.5 m -89.79 172.89 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.126 -0.984 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.67 91.73 3.69 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.887 . . . . 0.0 109.459 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.471 HG12 HG23 ' A' ' 66' ' ' VAL . 29.7 mm -88.64 107.48 17.31 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.266 -0.896 . . . . 0.0 110.452 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.474 ' HG2' ' CD1' ' A' ' 72' ' ' ILE . 43.9 Cg_endo -54.66 -169.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.002 1.528 . . . . 0.0 110.231 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.65 -6.77 24.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.265 -0.897 . . . . 0.0 110.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -84.71 -23.81 29.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.351 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.519 ' HA ' ' O ' ' A' ' 8' ' ' LYS . 3.5 mt -94.2 135.42 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.439 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.1 m -95.14 119.84 34.33 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.158 -0.964 . . . . 0.0 110.328 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.424 HG11 HD22 ' A' ' 63' ' ' LEU . 88.0 t -102.15 97.72 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.86 . . . . 0.0 109.562 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 59.0 m -102.53 172.12 7.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.568 -1.333 . . . . 0.0 110.698 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.3 p -111.96 177.28 4.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.333 -0.855 . . . . 0.0 109.747 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.449 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -179.25 179.06 48.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.479 ' O ' ' O ' ' B' ' 78' ' ' PHE . 25.7 m-85 -147.75 136.87 22.23 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -1.1 . . . . 0.0 110.124 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.402 ' HE3' ' CD2' ' B' ' 6' ' ' HIS . 2.5 mtp -119.94 172.61 7.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.116 -0.99 . . . . 0.0 110.408 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.19 100.96 7.49 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.294 -0.879 . . . . 0.0 109.725 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.404 -179.472 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.472 ' HE2' ' HB3' ' B' ' 78' ' ' PHE . 3.2 mtp . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.175 0.512 . . . . 0.0 110.322 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -105.98 108.27 61.3 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.35 -0.844 . . . . 0.0 110.366 -179.916 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.7 Cg_endo -67.87 143.26 60.26 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.917 1.483 . . . . 0.0 109.9 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.489 ' O ' HG11 ' B' ' 5' ' ' VAL . 2.8 pt -144.59 164.59 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.076 -1.015 . . . . 0.0 110.649 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.489 HG11 ' O ' ' B' ' 4' ' ' ILE . 16.8 m -144.4 147.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.524 -0.735 . . . . 0.0 109.504 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.402 ' CD2' ' HE3' ' A' ' 79' ' ' MET . 0.3 OUTLIER -105.84 128.2 53.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.995 -1.066 . . . . 0.0 110.53 -179.524 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.455 ' O ' ' CG2' ' B' ' 48' ' ' ILE . 0.2 OUTLIER -117.24 135.59 53.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.366 -0.834 . . . . 0.0 109.954 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.507 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 14.4 ttmt -139.78 164.35 30.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.211 -0.931 . . . . 0.0 110.11 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.403 ' H ' ' HG2' ' B' ' 8' ' ' LYS . . . 152.66 -175.7 31.14 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.79 136.39 56.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.322 -1.105 . . . . 0.0 110.127 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.15 -21.75 1.43 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.341 -0.849 . . . . 0.0 110.456 -179.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -70.44 -58.99 3.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.203 -0.936 . . . . 0.0 110.024 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.416 ' O ' ' HG ' ' B' ' 17' ' ' LEU . 0.0 OUTLIER -58.1 -22.27 49.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.352 -0.843 . . . . 0.0 110.238 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 18.8 mt -66.75 -45.49 78.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.568 -179.733 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.79 -31.13 69.4 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.153 -0.967 . . . . 0.0 110.325 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.488 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.1 t -70.28 -41.74 73.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.399 -0.813 . . . . 0.0 110.682 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.416 ' HG ' ' O ' ' B' ' 13' ' ' THR . 83.2 mt -58.88 -52.69 64.65 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.018 -1.051 . . . . 0.0 110.333 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . 0.504 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 23.0 ttt-85 -48.68 -24.16 1.28 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.488 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 9.8 t80 -64.68 -40.62 95.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.025 -1.047 . . . . 0.0 110.316 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 69.9 mtm-85 -76.28 -14.82 60.1 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.226 -0.921 . . . . 0.0 110.038 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.504 ' HB2' ' O ' ' B' ' 18' ' ' ARG . 3.7 m-30 -66.57 -31.09 71.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.24 -0.913 . . . . 0.0 109.85 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -63.38 -33.89 76.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.373 -0.829 . . . . 0.0 110.169 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -74.85 -49.06 21.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.677 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.487 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 47.0 m-70 -94.9 28.79 2.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.378 -0.826 . . . . 0.0 109.748 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.598 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 21.2 p -57.07 -21.8 34.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.759 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 23.6 p -97.27 10.78 38.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 110.073 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' B' ' 24' ' ' HIS . 0.7 OUTLIER -92.16 -44.09 8.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.244 -0.91 . . . . 0.0 110.377 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.61 ' CE1' HG11 ' B' ' 31' ' ' VAL . 20.8 p90 -95.82 175.44 6.51 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.095 -1.003 . . . . 0.0 109.837 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.449 ' OG1' ' HB2' ' B' ' 54' ' ' ASP . 80.7 m -100.95 -33.69 10.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.108 -0.995 . . . . 0.0 111.429 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.75 118.82 2.48 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.049 -1.032 . . . . 0.0 110.972 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.61 HG11 ' CE1' ' B' ' 28' ' ' TYR . 8.1 m -89.43 99.84 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.649 179.074 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.491 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.2 p -47.24 143.18 3.43 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.317 -0.865 . . . . 0.0 110.776 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' SER . . . . . 0.467 ' HA ' ' O ' ' A' ' 39' ' ' GLY . 14.1 p -61.62 164.48 5.94 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.907 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 65.8 m -68.04 121.02 15.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.114 -0.991 . . . . 0.0 110.345 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.557 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 31.2 p-90 -146.74 -173.43 4.21 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.341 -0.85 . . . . 0.0 109.539 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.549 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 28.9 t-80 -162.89 171.25 16.91 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.852 -1.155 . . . . 0.0 110.917 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.549 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 26.9 m95 -78.79 93.63 5.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.504 -0.748 . . . . 0.0 110.045 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t -174.17 167.11 4.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.93 . . . . 0.0 110.438 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.58 -114.79 0.01 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 19.0 p80 -128.46 -12.47 4.99 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.192 -1.181 . . . . 0.0 110.583 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . 0.475 ' O ' HG12 ' B' ' 42' ' ' VAL . 3.0 t-20 -141.12 127.9 20.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.156 -0.965 . . . . 0.0 110.307 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.475 HG12 ' O ' ' B' ' 41' ' ' ASN . 0.1 OUTLIER -159.57 160.85 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.308 -0.87 . . . . 0.0 110.058 179.771 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -99.36 -27.54 13.71 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.223 -0.923 . . . . 0.0 110.483 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -57.63 168.26 0.9 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.243 -0.911 . . . . 0.0 110.338 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -126.22 122.91 36.92 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.36 -0.837 . . . . 0.0 110.065 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.506 ' O ' HG13 ' B' ' 48' ' ' ILE . 5.5 p -165.21 34.37 0.06 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.133 -0.979 . . . . 0.0 110.43 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.85 143.02 3.06 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.216 -0.928 . . . . 0.0 110.247 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.546 HG23 ' N ' ' B' ' 49' ' ' VAL . 56.0 mt -141.87 150.29 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.171 -0.955 . . . . 0.0 110.098 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . 0.546 ' N ' HG23 ' B' ' 48' ' ' ILE . 41.3 t -121.11 121.17 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.233 -0.917 . . . . 0.0 110.731 -179.505 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.46 ' HB ' ' OG ' ' B' ' 32' ' ' SER . 40.7 m -93.89 148.85 21.75 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.292 -0.88 . . . . 0.0 109.17 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.497 HD23 ' CE2' ' B' ' 21' ' ' PHE . 0.4 OUTLIER -134.93 123.17 22.98 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.942 -1.099 . . . . 0.0 111.048 -179.417 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.479 ' HA ' ' O ' ' B' ' 3' ' ' PRO . 24.1 m -98.19 143.81 28.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.515 -0.741 . . . . 0.0 109.61 179.042 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.501 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -120.52 155.31 33.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.066 -1.021 . . . . 0.0 110.552 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.449 ' HB2' ' OG1' ' B' ' 29' ' ' THR . 3.0 t70 -77.69 -9.14 58.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.301 -0.874 . . . . 0.0 110.761 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.2 m -163.28 128.06 3.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.128 -0.983 . . . . 0.0 110.493 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -41.54 10.58 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.345 -0.847 . . . . 0.0 109.794 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . 0.456 ' HA ' ' CE3' ' B' ' 57' ' ' TRP . 6.0 t-105 -54.26 -51.22 65.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.318 -0.864 . . . . 0.0 110.027 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.44 ' CA ' ' OE1' ' B' ' 58' ' ' GLN . 4.1 tp60 -58.21 -37.25 74.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.16 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 40.0 ttp85 -59.32 -44.84 92.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.091 -1.006 . . . . 0.0 110.609 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -36.87 80.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.157 -0.964 . . . . 0.0 110.286 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.411 ' NE2' ' HA ' ' B' ' 58' ' ' GLN . 38.4 mt-30 -65.74 -41.08 92.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.292 -0.88 . . . . 0.0 110.29 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.49 ' CE1' HG22 ' B' ' 66' ' ' VAL . 21.5 t80 -56.11 -48.28 76.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 0.0 110.223 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 15.0 mt -59.04 -14.2 8.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.357 -0.839 . . . . 0.0 110.277 -179.756 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 17.8 p -100.54 -21.91 15.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.249 -0.907 . . . . 0.0 110.842 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . 0.423 ' OE1' HD21 ' B' ' 27' ' ' LEU . 30.3 mt-30 -94.09 -28.67 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.026 -1.046 . . . . 0.0 110.596 -178.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.49 HG22 ' CE1' ' B' ' 62' ' ' PHE . 5.5 m -89.57 173.13 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.033 -1.042 . . . . 0.0 110.028 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.14 92.63 3.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.219 -0.926 . . . . 0.0 109.28 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.458 HG12 HG23 ' B' ' 66' ' ' VAL . 30.2 mm -88.99 107.23 16.39 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.366 -0.834 . . . . 0.0 110.438 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.464 ' HG2' ' CD1' ' B' ' 72' ' ' ILE . 44.8 Cg_endo -54.18 -168.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 124.034 1.544 . . . . 0.0 110.145 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.17 -6.52 24.17 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.138 -0.976 . . . . 0.0 110.411 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 47.8 p -84.84 -23.54 29.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.268 -0.895 . . . . 0.0 110.382 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.507 ' HA ' ' O ' ' B' ' 8' ' ' LYS . 3.5 mt -94.15 135.23 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.258 -0.901 . . . . 0.0 110.416 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 39.7 m -95.22 119.87 34.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.174 -0.954 . . . . 0.0 110.217 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 88.6 t -101.81 97.69 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.171 -0.956 . . . . 0.0 109.42 177.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 58.2 m -102.47 172.2 7.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.476 -1.39 . . . . 0.0 110.628 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 72.8 p -112.53 176.34 5.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.401 -0.812 . . . . 0.0 109.823 179.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . 0.434 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -178.45 179.44 48.64 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.479 ' O ' ' O ' ' A' ' 78' ' ' PHE . 26.7 m-85 -147.57 137.35 22.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -1.149 . . . . 0.0 110.194 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.568 ' HE3' ' CD2' ' A' ' 6' ' ' HIS . 2.6 mtp -120.11 172.64 7.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.129 -0.982 . . . . 0.0 110.338 -179.878 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.78 100.97 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.305 -0.872 . . . . 0.0 109.73 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.191 -179.542 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.416 ' SD ' ' CE2' ' A' ' 78' ' ' PHE . 69.1 mtp . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.188 0.518 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.5 p -143.97 144.99 28.54 Favored Pre-proline 0 N--CA 1.491 1.577 0 O-C-N 121.253 -0.905 . . . . 0.0 110.272 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.487 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 51.7 Cg_endo -94.16 155.93 2.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.047 1.551 . . . . 0.0 110.062 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . 0.446 HD11 ' HG3' ' A' ' 79' ' ' MET . 11.4 pt -144.32 166.55 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.136 -0.977 . . . . 0.0 110.563 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.509 HG11 ' CG2' ' A' ' 74' ' ' VAL . 24.4 t -145.72 124.14 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.378 -0.827 . . . . 0.0 110.017 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.499 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.2 OUTLIER -105.69 110.57 22.92 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 110.274 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.517 ' O ' ' CG2' ' A' ' 48' ' ' ILE . 1.7 tp -112.97 150.59 31.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.201 -0.937 . . . . 0.0 110.258 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.476 ' N ' ' HG ' ' A' ' 7' ' ' LEU . 8.5 ttpp -142.33 170.43 15.72 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.51 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.451 ' O ' ' HB3' ' A' ' 46' ' ' SER . . . 151.24 -179.87 27.54 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -65.04 137.12 57.5 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.276 -1.132 . . . . 0.0 110.217 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.32 -31.44 14.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.31 -0.869 . . . . 0.0 110.629 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -71.14 -55.1 8.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.224 -0.922 . . . . 0.0 110.765 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.1 m -57.85 -20.46 36.56 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.189 -0.945 . . . . 0.0 110.398 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . 0.432 HD11 ' O ' ' A' ' 9' ' ' GLY . 20.9 mt -90.34 -25.05 20.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.309 -0.87 . . . . 0.0 110.083 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.4 mmtp -58.88 -42.62 89.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.345 -0.847 . . . . 0.0 110.294 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.433 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 19.0 t -69.8 -34.5 73.8 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.425 -0.797 . . . . 0.0 110.435 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 19' ' ' TYR . 5.3 mp -58.85 -53.59 56.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.35 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -44.87 -22.97 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.8 -179.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.433 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 85.7 t80 -64.57 -42.91 95.33 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.101 -0.999 . . . . 0.0 109.877 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -62.6 -27.44 69.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.864 . . . . 0.0 109.969 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.526 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.6 -16.86 64.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.375 -0.828 . . . . 0.0 110.264 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -63.44 -56.11 18.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 109.804 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.448 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.27 -24.76 57.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.399 -0.813 . . . . 0.0 109.834 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.478 ' O ' ' HB2' ' A' ' 27' ' ' LEU . 19.5 m170 -94.97 33.21 1.53 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.397 -0.815 . . . . 0.0 110.015 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.463 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 23.0 p -57.28 -23.79 50.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.349 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.7 t -97.28 13.52 29.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.194 -0.941 . . . . 0.0 110.687 -179.655 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.478 ' HB2' ' O ' ' A' ' 24' ' ' HIS . 3.3 mp -92.31 -26.54 18.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -0.983 . . . . 0.0 110.32 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.463 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 34.8 p90 -118.39 167.89 11.14 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -0.988 . . . . 0.0 110.034 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.494 ' N ' ' O ' ' A' ' 52' ' ' THR . 3.6 m -100.01 -34.24 10.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.127 -0.983 . . . . 0.0 110.457 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.62 117.06 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.926 . . . . 0.0 110.636 -179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.8 p -90.21 129.74 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.113 -0.992 . . . . 0.0 109.919 179.492 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.491 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 2.0 t -87.4 148.1 25.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.235 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 p -61.18 167.31 3.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.21 -0.931 . . . . 0.0 110.45 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.02 121.07 15.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.281 -0.887 . . . . 0.0 110.538 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.457 ' O ' ' N ' ' A' ' 48' ' ' ILE . 36.8 p-90 -146.93 175.47 10.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.247 -0.908 . . . . 0.0 109.847 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.493 ' HB3' ' HA ' ' A' ' 47' ' ' ALA . 15.2 p-80 -162.57 173.39 14.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.07 -1.019 . . . . 0.0 110.702 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.4 ' CZ2' ' HH2' ' A' ' 35' ' ' TRP . 92.2 m95 -79.66 125.35 29.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.531 -0.73 . . . . 0.0 110.106 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.5 t -164.53 164.27 21.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.076 -1.015 . . . . 0.0 110.269 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.34 -66.35 0.09 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -166.2 -48.66 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.257 -1.143 . . . . 0.0 110.163 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -125.35 63.61 1.17 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.92 . . . . 0.0 110.138 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 18.7 m -134.39 154.72 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.342 -0.849 . . . . 0.0 110.079 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 1.0 OUTLIER -53.88 130.4 37.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.206 -0.934 . . . . 0.0 110.166 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -56.67 145.01 30.12 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 110.047 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -108.84 177.98 4.61 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.168 -0.958 . . . . 0.0 110.296 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.488 ' O ' HG13 ' A' ' 48' ' ' ILE . 15.1 m -84.36 116.54 23.08 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.908 . . . . 0.0 110.254 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.493 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . -35.9 152.2 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.683 -0.636 . . . . 0.0 110.679 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.517 ' CG2' ' O ' ' A' ' 7' ' ' LEU . 46.3 mt -141.98 131.42 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.187 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.3 t -118.34 125.89 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.243 -0.911 . . . . 0.0 110.189 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.457 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 88.0 m -93.82 157.43 16.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.221 -0.924 . . . . 0.0 110.094 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.6 mt -134.84 128.21 32.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.179 -0.951 . . . . 0.0 110.07 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.494 ' O ' ' N ' ' A' ' 29' ' ' THR . 28.4 p -97.12 131.6 43.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.503 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 48.6 m-85 -112.52 150.21 31.6 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.185 -0.947 . . . . 0.0 110.218 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -74.96 -7.65 54.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.221 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.8 p -170.74 157.94 5.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.27 -0.894 . . . . 0.0 110.197 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.54 -37.64 88.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.325 -0.859 . . . . 0.0 110.354 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -54.03 -53.59 50.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.155 -0.965 . . . . 0.0 110.324 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -58.22 -35.46 71.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.299 -0.875 . . . . 0.0 110.44 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . 0.481 ' NH2' ' CG2' ' A' ' 76' ' ' THR . 22.4 ttt180 -58.91 -42.55 89.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.047 -1.033 . . . . 0.0 109.963 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -34.8 76.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -65.62 -45.5 82.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.185 -0.947 . . . . 0.0 110.466 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.576 ' CE1' HG23 ' A' ' 66' ' ' VAL . 3.0 t80 -55.96 -49.47 73.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.279 -0.888 . . . . 0.0 110.826 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . 0.402 ' O ' HG22 ' A' ' 66' ' ' VAL . 97.6 mt -59.28 -46.06 89.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.266 -0.896 . . . . 0.0 110.765 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.1 -20.59 66.54 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.129 -0.982 . . . . 0.0 110.417 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -95.81 -17.39 21.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.91 . . . . 0.0 110.42 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.576 HG23 ' CE1' ' A' ' 62' ' ' PHE . 10.9 m -108.66 113.44 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -0.939 . . . . 0.0 110.409 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 115.62 9.9 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 110.064 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 4.2 tp -88.31 142.62 31.67 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.194 -0.941 . . . . 0.0 110.207 -179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.451 ' CG ' HD12 ' A' ' 72' ' ' ILE . 47.8 Cg_endo -94.72 162.4 1.81 Allowed 'Trans proline' 0 C--N 1.305 -1.762 0 O-C-N 124.034 1.544 . . . . 0.0 110.464 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -65.35 -16.76 63.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.227 -0.921 . . . . 0.0 110.347 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.3 m -84.68 -31.42 24.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 110.576 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.451 HD12 ' CG ' ' A' ' 69' ' ' PRO . 75.6 mt -93.51 148.94 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.096 -1.003 . . . . 0.0 110.641 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.512 HG22 ' N ' ' A' ' 74' ' ' VAL . 87.7 m -145.52 154.15 41.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.399 -0.813 . . . . 0.0 109.994 179.815 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.512 ' N ' HG22 ' A' ' 73' ' ' THR . 6.0 p -147.12 162.81 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.108 -0.995 . . . . 0.0 110.647 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.25 -179.63 5.98 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.439 -0.788 . . . . 0.0 109.997 -179.817 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.481 ' CG2' ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -108.08 167.72 9.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.159 -0.963 . . . . 0.0 110.354 -179.813 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . 0.454 ' HA3' ' HE3' ' B' ' 79' ' ' MET . . . -169.79 177.71 43.1 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . 0.416 ' CE2' ' SD ' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.81 135.86 21.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.37 -1.077 . . . . 0.0 110.114 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.446 ' HG3' HD11 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -117.87 153.86 32.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.253 -0.904 . . . . 0.0 110.269 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.8 p -125.35 100.73 6.64 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.285 -0.884 . . . . 0.0 110.176 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.4 tt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.19 -179.966 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.443 ' O ' HG23 ' B' ' 2' ' ' THR . 71.3 mtp . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.164 0.507 . . . . 0.0 110.081 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' THR . . . . . 0.443 HG23 ' O ' ' B' ' 1' ' ' MET . 29.2 p -145.34 143.39 20.09 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.17 -0.956 . . . . 0.0 110.343 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.488 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.8 Cg_endo -92.49 155.9 3.0 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.068 1.562 . . . . 0.0 110.214 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . 0.407 HD11 ' HG3' ' B' ' 79' ' ' MET . 11.2 pt -144.23 166.36 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 110.501 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.509 ' CG1' HG21 ' B' ' 74' ' ' VAL . 24.5 t -145.77 124.07 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.264 -0.898 . . . . 0.0 110.03 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.502 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.2 OUTLIER -105.59 111.11 23.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 110.343 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.515 ' O ' ' CG2' ' B' ' 48' ' ' ILE . 1.8 tp -113.32 150.13 32.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 110.138 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.455 ' N ' ' HG ' ' B' ' 7' ' ' LEU . 8.5 ttpp -142.04 169.98 16.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.278 -0.889 . . . . 0.0 110.312 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.445 ' O ' ' HB3' ' B' ' 46' ' ' SER . . . 151.96 -179.98 28.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -65.07 137.85 57.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.204 -1.174 . . . . 0.0 110.199 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.43 -31.9 16.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.262 -0.899 . . . . 0.0 110.573 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -70.92 -55.16 9.01 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.273 -0.892 . . . . 0.0 110.846 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.3 m -57.5 -20.96 34.7 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.179 -0.951 . . . . 0.0 110.391 -179.503 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . 0.413 HD11 ' O ' ' B' ' 9' ' ' GLY . 19.3 mt -90.15 -24.8 20.96 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp -58.91 -42.68 90.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.338 -0.851 . . . . 0.0 110.251 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.445 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.8 t -69.6 -34.98 74.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.417 -0.802 . . . . 0.0 110.36 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' B' ' 19' ' ' TYR . 5.5 mp -58.69 -53.64 56.13 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.343 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.2 ttp85 -44.59 -23.44 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.217 -0.927 . . . . 0.0 110.728 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.445 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 85.8 t80 -64.51 -43.43 94.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.022 -1.049 . . . . 0.0 109.852 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 7.8 mtp85 -61.97 -27.51 68.9 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.391 -0.818 . . . . 0.0 109.987 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.56 -16.99 64.57 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.283 -0.886 . . . . 0.0 110.268 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -63.47 -56.07 19.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.0 109.806 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . 0.44 ' HD3' ' N ' ' B' ' 23' ' ' LYS . 0.0 OUTLIER -75.07 -24.91 58.27 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 109.875 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.48 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 18.7 m170 -94.93 32.89 1.57 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.413 -0.805 . . . . 0.0 110.106 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.491 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 24.8 p -57.19 -23.6 48.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 0.0 110.395 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.7 t -97.26 13.42 29.53 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 110.674 -179.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.48 ' HB2' ' O ' ' B' ' 24' ' ' HIS . 3.2 mp -92.35 -26.39 18.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.491 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 33.9 p90 -118.36 167.97 11.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.11 -0.994 . . . . 0.0 109.979 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.489 ' N ' ' O ' ' B' ' 52' ' ' THR . 3.7 m -100.29 -34.23 10.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.203 -0.936 . . . . 0.0 110.492 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.52 116.37 2.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.21 -0.931 . . . . 0.0 110.624 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.424 HG23 HD21 ' B' ' 51' ' ' LEU . 14.5 p -90.02 129.89 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 110.005 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.446 ' OG ' ' CE3' ' A' ' 35' ' ' TRP . 2.1 t -87.54 148.41 24.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.41 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.5 p -61.07 166.99 3.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.413 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.99 120.77 14.79 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.287 -0.883 . . . . 0.0 110.423 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.491 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 37.2 p-90 -146.58 175.26 10.72 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.224 -0.922 . . . . 0.0 109.932 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.486 ' HB3' ' HA ' ' B' ' 47' ' ' ALA . 16.7 p-80 -162.5 172.97 14.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.092 -1.005 . . . . 0.0 110.724 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.412 ' CZ2' ' HH2' ' B' ' 35' ' ' TRP . 92.7 m95 -79.45 124.57 28.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.502 -0.749 . . . . 0.0 110.078 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 7.0 t -163.8 164.95 23.44 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.256 -0.902 . . . . 0.0 110.318 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -132.37 -67.38 0.08 OUTLIER Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -164.85 -49.9 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -1.183 . . . . 0.0 110.349 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -123.85 62.23 1.07 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.144 -0.973 . . . . 0.0 110.379 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 21.3 m -133.08 155.18 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.271 -0.893 . . . . 0.0 110.133 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' B' ' 43' ' ' LYS . 1.0 OUTLIER -54.24 131.43 41.51 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.293 -0.879 . . . . 0.0 110.174 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -57.44 144.95 34.59 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.277 -0.889 . . . . 0.0 110.122 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -108.25 178.26 4.55 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.147 -0.97 . . . . 0.0 110.276 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.502 ' O ' HG13 ' B' ' 48' ' ' ILE . 15.0 m -84.75 116.33 23.19 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.888 . . . . 0.0 110.221 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.489 ' C ' ' O ' ' B' ' 46' ' ' SER . . . -35.64 151.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.615 -0.678 . . . . 0.0 110.657 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.515 ' CG2' ' O ' ' B' ' 7' ' ' LEU . 46.7 mt -142.06 130.31 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.376 -0.828 . . . . 0.0 110.101 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 4.2 t -117.34 125.96 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.884 . . . . 0.0 110.177 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.446 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 88.0 m -93.79 157.5 16.11 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . 0.424 HD21 HG23 ' B' ' 31' ' ' VAL . 9.4 mt -135.09 128.36 32.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 110.286 -179.87 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.489 ' O ' ' N ' ' B' ' 29' ' ' THR . 30.7 p -97.22 132.2 43.21 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.279 -0.888 . . . . 0.0 110.276 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.498 ' N ' ' CD1' ' B' ' 53' ' ' TYR . 49.0 m-85 -113.01 150.36 32.04 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.288 -0.882 . . . . 0.0 110.021 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -75.13 -7.22 53.17 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.895 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 24.9 p -170.72 157.72 5.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.317 -0.864 . . . . 0.0 110.283 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.46 -38.21 90.24 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.265 -0.897 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 8.5 t-105 -53.83 -53.72 48.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.363 -0.836 . . . . 0.0 110.447 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -57.74 -35.43 70.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.473 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . 0.468 ' NH2' ' CG2' ' B' ' 76' ' ' THR . 23.3 ttt180 -58.94 -42.81 90.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.075 -1.016 . . . . 0.0 110.123 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.41 -34.48 75.45 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.322 -0.861 . . . . 0.0 110.333 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -65.77 -45.26 83.16 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.248 -0.908 . . . . 0.0 110.393 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.567 ' CE1' HG23 ' B' ' 66' ' ' VAL . 3.2 t80 -56.1 -49.66 73.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.281 -0.887 . . . . 0.0 110.763 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.403 ' O ' HG22 ' B' ' 66' ' ' VAL . 97.5 mt -59.22 -46.15 89.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.192 -0.942 . . . . 0.0 110.746 -179.355 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.18 -20.7 66.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.204 -0.935 . . . . 0.0 110.436 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -95.7 -17.95 20.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.275 -0.89 . . . . 0.0 110.392 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.567 HG23 ' CE1' ' B' ' 62' ' ' PHE . 12.4 m -107.87 114.22 45.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.244 -0.91 . . . . 0.0 110.328 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.41 115.94 11.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.045 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 4.1 tp -88.07 143.65 33.33 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.198 -0.939 . . . . 0.0 110.264 -179.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.441 ' CG ' HD12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -95.71 161.83 1.45 Allowed 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.059 1.557 . . . . 0.0 110.344 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -65.23 -16.3 63.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.302 -0.874 . . . . 0.0 110.251 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 40.7 m -84.88 -31.35 23.77 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.256 -0.903 . . . . 0.0 110.463 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.441 HD12 ' CG ' ' B' ' 69' ' ' PRO . 70.4 mt -93.65 148.83 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.157 -0.964 . . . . 0.0 110.599 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' THR . . . . . 0.515 HG22 ' N ' ' B' ' 74' ' ' VAL . 90.9 m -145.5 154.14 41.89 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.354 -0.842 . . . . 0.0 110.028 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.515 ' N ' HG22 ' B' ' 73' ' ' THR . 6.1 p -147.22 162.81 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.112 -0.992 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.16 -179.86 6.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.375 -0.828 . . . . 0.0 109.955 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' THR . . . . . 0.468 ' CG2' ' NH2' ' B' ' 59' ' ' ARG . 0.2 OUTLIER -107.72 167.47 9.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 0.0 110.435 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.24 177.5 42.88 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . 0.425 ' CE2' ' SD ' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.73 135.95 21.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.26 -1.141 . . . . 0.0 110.111 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.454 ' HE3' ' HA3' ' A' ' 77' ' ' GLY . 0.2 OUTLIER -117.94 154.24 32.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 110.281 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.5 p -125.5 100.69 6.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 110.132 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.25 -179.918 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtp . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.279 0.562 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.37 160.46 25.96 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.863 . . . . 0.0 109.989 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PRO . . . . . 0.501 ' CG ' ' O ' ' A' ' 53' ' ' TYR . 51.8 Cg_endo -114.82 159.16 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 123.885 1.466 . . . . 0.0 110.09 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 pt -144.49 164.37 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 110.221 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.402 ' CG1' ' CG2' ' A' ' 74' ' ' VAL . 97.8 t -145.94 127.64 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . 0.481 ' HB2' ' CE ' ' B' ' 79' ' ' MET . 0.1 OUTLIER -105.63 115.81 30.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.0 110.473 -179.673 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . 0.538 ' O ' ' CG2' ' A' ' 48' ' ' ILE . 0.6 OUTLIER -118.53 149.76 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.382 -0.824 . . . . 0.0 109.909 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.46 ' N ' ' HG ' ' A' ' 7' ' ' LEU . 7.4 ttpt -142.72 171.89 13.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.043 -1.036 . . . . 0.0 110.637 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . 0.439 ' HA3' HG12 ' A' ' 72' ' ' ILE . . . 151.51 173.86 21.75 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -64.99 138.23 58.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.16 -1.2 . . . . 0.0 110.056 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.29 -25.56 3.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.25 -0.906 . . . . 0.0 110.691 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' A' ' 15' ' ' LYS . 25.9 t30 -65.55 -61.36 2.14 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.961 . . . . 0.0 110.598 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' THR . . . . . 0.458 ' HB ' HD13 ' A' ' 72' ' ' ILE . 0.2 OUTLIER -57.87 -32.47 67.71 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.101 -0.999 . . . . 0.0 110.338 -179.769 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -67.75 -30.29 69.72 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 0.0 110.01 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 10.0 mmtp -59.99 -45.61 92.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.216 -0.928 . . . . 0.0 110.149 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.508 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 5.7 t -70.08 -36.56 75.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.472 -0.767 . . . . 0.0 110.739 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.9 -56.69 19.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.899 -1.125 . . . . 0.0 110.668 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -47.08 -21.33 0.22 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.676 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.508 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 91.0 t80 -64.27 -27.25 68.91 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.006 -1.059 . . . . 0.0 109.818 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 -79.6 -31.9 41.8 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.264 -0.898 . . . . 0.0 109.882 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . 0.557 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 8.8 m-30 -66.33 -14.93 62.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -0.863 . . . . 0.0 110.101 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -63.43 -55.67 22.38 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.477 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 1.8 mptt -75.18 -22.7 57.84 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' HIS . . . . . 0.57 ' N ' ' CD2' ' A' ' 24' ' ' HIS . 11.3 m170 -95.04 38.93 1.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.264 -0.897 . . . . 0.0 110.172 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' CYS . . . . . 0.482 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 25.1 p -57.0 -25.43 58.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.358 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.8 t -97.49 11.34 37.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.268 -0.895 . . . . 0.0 110.76 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.524 ' O ' ' NE2' ' A' ' 58' ' ' GLN . 3.0 mp -92.33 -32.41 15.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.083 -1.011 . . . . 0.0 110.355 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' TYR . . . . . 0.482 ' CE1' ' HA ' ' A' ' 25' ' ' CYS . 50.6 p90 -113.38 171.74 7.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.189 -0.945 . . . . 0.0 109.615 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.471 ' HB ' ' O ' ' A' ' 52' ' ' THR . 61.7 m -101.16 -36.22 9.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.056 -1.028 . . . . 0.0 111.064 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.4 122.54 3.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.023 -1.048 . . . . 0.0 110.798 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.448 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 11.0 p -88.16 108.16 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.162 -0.961 . . . . 0.0 109.891 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . 0.556 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -63.46 146.55 53.4 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.423 -0.798 . . . . 0.0 110.99 -179.403 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . 0.462 ' HB3' HG23 ' B' ' 38' ' ' THR . 36.3 p -61.58 163.41 7.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.403 -0.811 . . . . 0.0 110.258 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 115.62 7.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.321 -0.862 . . . . 0.0 110.647 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TRP . . . . . 0.558 ' CB ' ' HB3' ' B' ' 35' ' ' TRP . 16.5 p-90 -146.92 168.66 20.92 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.267 -0.896 . . . . 0.0 110.091 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.546 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 14.2 p-80 -162.47 178.48 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . 0.571 ' CH2' HG23 ' B' ' 52' ' ' THR . 80.4 m95 -79.73 125.18 29.33 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.551 -0.718 . . . . 0.0 110.467 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' THR . . . . . 0.482 HG23 ' HB3' ' B' ' 33' ' ' SER . 7.1 t -164.8 152.54 11.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.918 . . . . 0.0 110.271 179.832 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -112.48 -88.73 1.77 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -157.64 -42.14 0.07 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.211 -1.17 . . . . 0.0 110.127 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.24 56.06 1.12 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.283 -0.886 . . . . 0.0 110.201 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . 0.439 HG22 ' N ' ' A' ' 43' ' ' LYS . 4.1 m -131.17 -157.17 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.265 -0.897 . . . . 0.0 110.179 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LYS . . . . . 0.462 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 18.2 pttt -95.67 130.85 42.43 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.181 -0.949 . . . . 0.0 110.283 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 29.5 m80 -53.4 145.48 14.35 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.194 -0.941 . . . . 0.0 110.072 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -114.81 146.3 41.19 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.166 -0.959 . . . . 0.0 110.294 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . 0.444 ' O ' ' C ' ' A' ' 47' ' ' ALA . 65.5 m -57.96 116.97 3.83 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.277 -0.889 . . . . 0.0 110.253 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . 0.469 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -38.81 158.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.553 -0.717 . . . . 0.0 110.165 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.538 ' CG2' ' O ' ' A' ' 7' ' ' LEU . 45.7 mt -140.83 131.34 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.271 -0.893 . . . . 0.0 110.262 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 52.9 t -110.48 117.18 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.308 -0.87 . . . . 0.0 110.691 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 96.2 m -94.14 153.81 17.91 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.21 -0.931 . . . . 0.0 109.626 179.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.8 mp -136.31 131.2 34.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.931 -1.106 . . . . 0.0 110.497 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.634 ' CG2' ' CH2' ' B' ' 37' ' ' TRP . 7.6 p -97.34 135.07 39.77 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.394 -0.816 . . . . 0.0 110.042 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.501 ' O ' ' CG ' ' A' ' 3' ' ' PRO . 88.8 m-85 -111.23 148.75 32.16 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.136 -0.978 . . . . 0.0 110.396 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -81.97 -8.79 59.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.213 -0.93 . . . . 0.0 110.151 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.94 138.45 6.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.334 -0.854 . . . . 0.0 110.196 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -54.79 -39.2 68.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.252 -0.905 . . . . 0.0 110.266 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.77 -51.74 62.45 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 51.3 tt0 -57.12 -40.79 77.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.359 -0.838 . . . . 0.0 110.743 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -59.18 -36.87 76.1 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.036 -1.04 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.08 -44.5 97.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.947 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLN . . . . . 0.485 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 47.8 mt-30 -65.61 -39.0 91.06 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.124 -0.985 . . . . 0.0 110.619 -179.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' PHE . . . . . 0.45 ' CD1' ' C ' ' A' ' 62' ' ' PHE . 3.0 t80 -54.85 -48.21 73.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.163 -0.961 . . . . 0.0 110.221 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -59.8 -25.95 65.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.191 -0.943 . . . . 0.0 110.163 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.78 -20.41 42.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.299 -0.875 . . . . 0.0 110.628 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 9.1 mm-40 -96.18 -20.58 18.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.159 -0.963 . . . . 0.0 110.418 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' VAL . . . . . 0.474 ' O ' HG22 ' A' ' 66' ' ' VAL . 32.2 m -103.24 118.96 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.247 -0.908 . . . . 0.0 110.413 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -78.31 114.09 16.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.433 HD12 HG22 ' A' ' 72' ' ' ILE . 3.5 tp -88.52 137.42 30.52 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.296 -0.878 . . . . 0.0 110.053 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.447 ' HD2' ' HB ' ' A' ' 72' ' ' ILE . 46.7 Cg_endo -98.82 159.95 0.68 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.894 1.47 . . . . 0.0 110.329 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.82 -13.04 8.8 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.238 -0.914 . . . . 0.0 110.157 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 94.5 m -84.28 -38.01 20.99 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.265 -0.897 . . . . 0.0 110.028 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.494 HG21 ' N ' ' A' ' 73' ' ' THR . 72.4 mt -93.97 149.48 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.314 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' THR . . . . . 0.494 ' N ' HG21 ' A' ' 72' ' ' ILE . 23.4 m -144.9 153.82 41.97 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.235 -0.915 . . . . 0.0 110.029 179.787 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.458 ' HA ' ' O ' ' A' ' 6' ' ' HIS . 3.3 p -146.54 159.47 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.664 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.54 -179.36 5.86 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.386 -0.821 . . . . 0.0 110.164 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 m -107.93 170.88 7.72 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.177 -0.952 . . . . 0.0 110.719 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.37 -178.57 40.72 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.1 138.0 22.53 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.237 -1.155 . . . . 0.0 110.246 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' MET . . . . . 0.531 ' CE ' ' HB2' ' B' ' 6' ' ' HIS . 0.9 OUTLIER -121.06 170.71 9.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.243 -0.911 . . . . 0.0 110.092 179.847 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' SER . . . . . 0.497 ' OG ' ' O ' ' A' ' 80' ' ' SER . 1.3 p -137.73 103.92 5.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 110.408 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . 0.541 ' O ' ' CG1' ' A' ' 81' ' ' ILE . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.114 -0.946 . . . . 0.0 109.976 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 64.8 mtp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.27 0.557 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.67 160.96 24.27 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 110.063 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . 0.502 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 49.9 Cg_endo -115.53 158.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 123.894 1.471 . . . . 0.0 110.04 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 5.0 pt -144.49 164.01 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 110.367 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' VAL . . . . . 0.404 ' CG1' ' CG2' ' B' ' 74' ' ' VAL . 98.0 t -145.84 127.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 109.955 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' HIS . . . . . 0.531 ' HB2' ' CE ' ' A' ' 79' ' ' MET . 0.1 OUTLIER -105.47 116.1 31.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.232 -0.917 . . . . 0.0 110.537 -179.642 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' LEU . . . . . 0.536 ' O ' ' CG2' ' B' ' 48' ' ' ILE . 0.6 OUTLIER -118.56 149.69 40.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.779 179.652 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' LYS . . . . . 0.449 ' N ' ' HG ' ' B' ' 7' ' ' LEU . 7.3 ttpt -142.43 172.31 12.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.076 -1.015 . . . . 0.0 110.461 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' GLY . . . . . 0.447 ' HA3' HG12 ' B' ' 72' ' ' ILE . . . 150.82 174.1 21.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 36.5 m-20 -65.08 138.55 58.39 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.152 -1.205 . . . . 0.0 110.252 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.47 -25.16 3.68 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' ASN . . . . . 0.473 ' O ' ' HB2' ' B' ' 15' ' ' LYS . 26.4 t30 -66.54 -61.49 1.96 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 0.0 110.692 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' THR . . . . . 0.461 ' HB ' HD13 ' B' ' 72' ' ' ILE . 0.2 OUTLIER -57.77 -31.72 66.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.053 -1.029 . . . . 0.0 110.388 -179.841 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.24 -30.55 69.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.184 -0.947 . . . . 0.0 110.008 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' B' ' 12' ' ' ASN . 10.2 mmtp -59.65 -45.45 91.97 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.19 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' CYS . . . . . 0.513 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 5.8 t -70.09 -36.25 74.77 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.881 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 1.6 mp -58.94 -56.91 16.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.978 -1.076 . . . . 0.0 110.648 -179.592 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 12.9 ttp85 -47.1 -21.43 0.24 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.263 -0.898 . . . . 0.0 110.655 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 91.5 t80 -64.19 -27.23 68.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.072 -1.017 . . . . 0.0 109.759 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -79.77 -31.66 40.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.354 -0.841 . . . . 0.0 109.836 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . 0.554 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.4 m-30 -66.44 -15.01 63.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.289 -0.882 . . . . 0.0 110.068 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -63.36 -55.94 20.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . 0.481 ' HD3' ' N ' ' B' ' 23' ' ' LYS . 1.7 mptt -75.05 -22.59 58.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.216 -0.928 . . . . 0.0 110.252 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' HIS . . . . . 0.566 ' CD2' ' N ' ' B' ' 24' ' ' HIS . 12.8 m170 -95.01 38.63 1.12 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' CYS . . . . . 0.518 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 25.1 p -57.13 -25.45 58.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.183 -0.948 . . . . 0.0 110.521 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 14.9 t -97.57 11.37 37.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.191 -0.943 . . . . 0.0 110.615 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' LEU . . . . . 0.512 ' O ' ' NE2' ' B' ' 58' ' ' GLN . 3.3 mp -92.3 -32.23 15.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.136 -0.978 . . . . 0.0 110.32 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' TYR . . . . . 0.518 ' CE1' ' HA ' ' B' ' 25' ' ' CYS . 50.2 p90 -113.49 172.06 7.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.236 -0.915 . . . . 0.0 109.665 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' THR . . . . . 0.469 ' HB ' ' O ' ' B' ' 52' ' ' THR . 57.3 m -101.49 -36.37 8.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.035 -1.04 . . . . 0.0 111.065 -179.77 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.39 122.46 3.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.043 -1.035 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' VAL . . . . . 0.446 ' CG1' ' O ' ' B' ' 31' ' ' VAL . 11.1 p -88.15 109.57 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.276 -0.89 . . . . 0.0 109.816 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' SER . . . . . 0.543 ' HB2' ' CZ3' ' A' ' 37' ' ' TRP . 0.3 OUTLIER -64.88 146.87 54.32 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.427 -0.796 . . . . 0.0 111.173 -179.254 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' SER . . . . . 0.482 ' HB3' HG23 ' A' ' 38' ' ' THR . 78.4 p -61.41 163.06 7.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.373 -0.83 . . . . 0.0 110.081 179.519 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.25 115.77 8.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.338 -0.851 . . . . 0.0 110.512 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' TRP . . . . . 0.558 ' HB3' ' CB ' ' A' ' 35' ' ' TRP . 17.7 p-90 -146.99 168.97 20.2 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.126 -0.984 . . . . 0.0 110.13 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . 0.518 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 12.7 p-80 -162.6 178.54 8.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 110.734 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' TRP . . . . . 0.634 ' CH2' ' CG2' ' A' ' 52' ' ' THR . 79.5 m95 -79.72 125.05 29.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.487 -0.758 . . . . 0.0 110.218 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' THR . . . . . 0.462 HG23 ' HB3' ' A' ' 33' ' ' SER . 6.8 t -164.42 151.56 11.57 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.313 -0.867 . . . . 0.0 110.254 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -111.88 -89.0 1.84 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 82.4 t60 -157.51 -42.2 0.07 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.329 -1.101 . . . . 0.0 110.207 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.53 55.55 1.16 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.282 -0.886 . . . . 0.0 110.255 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . 0.457 HG22 ' N ' ' B' ' 43' ' ' LYS . 4.3 m -130.32 -155.55 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 110.239 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' LYS . . . . . 0.457 ' N ' HG22 ' B' ' 42' ' ' VAL . 18.4 pttt -97.21 131.49 43.89 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.285 -0.884 . . . . 0.0 110.217 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -53.84 145.18 16.64 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.328 -0.857 . . . . 0.0 110.187 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -114.72 145.42 42.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.364 -0.835 . . . . 0.0 110.324 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' SER . . . . . 0.444 ' O ' ' O ' ' B' ' 47' ' ' ALA . 55.8 m -57.32 116.8 3.53 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.253 -0.904 . . . . 0.0 110.212 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' ALA . . . . . 0.475 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -39.02 158.52 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.411 -0.806 . . . . 0.0 110.091 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . 0.536 ' CG2' ' O ' ' B' ' 7' ' ' LEU . 44.2 mt -140.74 131.89 29.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.208 -0.932 . . . . 0.0 110.2 -179.134 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 53.7 t -111.11 116.64 53.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.21 -0.931 . . . . 0.0 110.53 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' THR . . . . . 0.404 ' O ' ' HB3' ' B' ' 32' ' ' SER . 98.2 m -93.72 154.03 18.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -0.894 . . . . 0.0 109.535 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 mp -136.17 131.44 34.65 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 110.54 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' THR . . . . . 0.571 HG23 ' CH2' ' A' ' 37' ' ' TRP . 9.1 p -97.62 135.3 39.64 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.273 -0.892 . . . . 0.0 110.028 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.502 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 91.1 m-85 -111.46 148.7 32.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.085 -1.009 . . . . 0.0 110.354 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' ASP . . . . . 0.419 ' OD2' ' OG1' ' B' ' 29' ' ' THR . 37.9 m-20 -82.46 -8.65 59.61 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.14 -0.975 . . . . 0.0 110.045 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.16 138.34 7.73 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 110.147 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -55.25 -39.25 69.55 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.339 -0.851 . . . . 0.0 110.169 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.71 -52.06 61.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 110.14 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 52.1 tt0 -57.07 -41.04 78.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.411 -0.805 . . . . 0.0 110.751 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -59.02 -36.2 74.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.977 -1.077 . . . . 0.0 110.267 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.272 -0.893 . . . . 0.0 110.984 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' GLN . . . . . 0.484 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 47.5 mt-30 -65.42 -38.55 90.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.599 -179.334 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' PHE . . . . . 0.422 ' CD1' ' C ' ' B' ' 62' ' ' PHE . 4.0 t80 -54.85 -48.18 73.23 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.64 -25.79 64.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.215 -0.928 . . . . 0.0 110.388 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.22 -20.42 41.11 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.325 -0.859 . . . . 0.0 110.505 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' GLN . . . . . 0.484 ' HG2' ' O ' ' B' ' 61' ' ' GLN . 8.9 mm-40 -96.4 -19.31 19.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.286 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' VAL . . . . . 0.458 HG22 ' O ' ' B' ' 66' ' ' VAL . 30.1 m -104.9 118.38 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.2 -0.937 . . . . 0.0 110.232 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -77.94 114.51 16.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.268 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' ILE . . . . . 0.417 HD12 HG22 ' B' ' 72' ' ' ILE . 3.3 tp -88.74 137.26 30.19 Favored Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.228 -0.92 . . . . 0.0 110.151 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' PRO . . . . . 0.465 ' HD2' ' HB ' ' B' ' 72' ' ' ILE . 47.8 Cg_endo -98.43 160.25 0.76 Allowed 'Trans proline' 0 C--N 1.303 -1.832 0 O-C-N 123.911 1.48 . . . . 0.0 110.212 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.03 -12.95 9.31 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.16 -0.962 . . . . 0.0 110.12 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 87.1 m -84.49 -38.24 20.34 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 110.118 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' ILE . . . . . 0.506 HG21 ' N ' ' B' ' 73' ' ' THR . 78.9 mt -93.81 149.76 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.219 -0.925 . . . . 0.0 110.229 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' THR . . . . . 0.506 ' N ' HG21 ' B' ' 72' ' ' ILE . 23.4 m -144.87 153.87 42.04 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.33 -0.857 . . . . 0.0 110.147 179.937 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' VAL . . . . . 0.466 ' HA ' ' O ' ' B' ' 6' ' ' HIS . 3.3 p -146.4 159.66 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.179 -0.95 . . . . 0.0 110.642 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 -179.55 6.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.418 -0.801 . . . . 0.0 110.04 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.5 m -107.8 170.93 7.69 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.081 -1.012 . . . . 0.0 110.715 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.5 -178.91 41.02 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -147.79 138.18 23.02 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -1.137 . . . . 0.0 110.34 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' MET . . . . . 0.481 ' CE ' ' HB2' ' A' ' 6' ' ' HIS . 0.5 OUTLIER -121.4 170.46 9.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.379 -0.825 . . . . 0.0 110.053 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' B' ' 80' ' ' SER . 1.3 p -137.64 104.24 5.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.17 -0.956 . . . . 0.0 110.341 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' ILE . . . . . 0.55 ' O ' ' CG1' ' B' ' 81' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.126 -0.984 . . . . 0.0 109.965 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.251 0.548 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.44 122.39 61.24 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.5 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -68.96 146.52 65.44 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.063 1.56 . . . . 0.0 110.197 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.422 ' CG1' ' O ' ' A' ' 4' ' ' ILE . 1.7 pp -143.98 117.38 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.168 -0.957 . . . . 0.0 110.364 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -94.13 153.38 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 109.999 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.585 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.2 OUTLIER -134.96 117.59 15.96 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.0 109.85 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.65 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.0 OUTLIER -113.66 148.65 35.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.311 -0.868 . . . . 0.0 110.199 -179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.529 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 16.6 tttm -142.72 168.1 20.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 110.225 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.529 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 151.11 -156.38 26.64 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.14 127.57 32.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.238 -1.154 . . . . 0.0 110.342 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.19 -27.03 5.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.099 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -77.75 -45.67 23.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.279 -0.888 . . . . 0.0 110.29 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 28.2 m -57.89 -21.76 44.88 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.163 -0.961 . . . . 0.0 110.086 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.987 ' HA ' HD12 ' A' ' 17' ' ' LEU . 30.6 mt -76.62 -29.69 56.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.872 . . . . 0.0 110.343 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -60.18 -39.46 86.54 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.229 -0.919 . . . . 0.0 110.59 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -69.91 -40.31 75.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.249 -0.907 . . . . 0.0 110.7 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.987 HD12 ' HA ' ' A' ' 14' ' ' LEU . 14.5 mt -58.51 -49.55 76.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.143 -0.973 . . . . 0.0 110.334 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.604 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 46.6 ttt-85 -45.04 -37.86 4.45 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.184 -0.948 . . . . 0.0 110.796 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.434 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 87.5 t80 -64.56 -41.77 96.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.103 -0.998 . . . . 0.0 110.344 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -57.67 -36.5 72.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.0 109.871 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 5.8 m-30 -66.79 -18.12 65.22 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.093 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 28.2 mmtt -63.31 -48.24 78.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.954 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.5 mmtt -74.83 -23.88 58.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.826 ' HB3' HD12 ' A' ' 27' ' ' LEU . 3.7 m-70 -95.23 33.92 1.49 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.967 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.563 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 21.2 p -56.75 -24.63 51.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.257 -0.902 . . . . 0.0 110.07 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.684 ' O ' HG23 ' A' ' 26' ' ' THR . 14.1 t -96.9 54.09 1.26 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 109.771 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.826 HD12 ' HB3' ' A' ' 24' ' ' HIS . 12.4 mt -147.78 -32.02 0.28 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -0.851 . . . . 0.0 110.755 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.563 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 9.2 p90 -108.76 167.51 10.01 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.928 -1.108 . . . . 0.0 110.012 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 m -100.66 -36.56 9.09 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.091 -1.006 . . . . 0.0 110.88 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.1 118.85 2.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.08 -1.013 . . . . 0.0 110.728 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.406 ' O ' HG13 ' A' ' 31' ' ' VAL . 9.8 p -89.94 136.06 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.266 -0.896 . . . . 0.0 109.935 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.599 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 28.4 p -96.36 149.83 21.26 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.071 -1.018 . . . . 0.0 110.303 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.31 162.02 8.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.22 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -68.0 127.88 34.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.328 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.602 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 40.9 p-90 -146.14 179.95 7.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.198 -0.939 . . . . 0.0 109.798 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.579 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 26.7 t-80 -162.71 173.82 13.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.863 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.579 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 55.9 m95 -78.6 93.35 4.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.401 -0.812 . . . . 0.0 109.834 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.6 t . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.312 -0.868 . . . . 0.0 110.42 -179.687 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.465 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 121.382 0.611 . . . . 0.0 110.559 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.65 HG23 ' O ' ' A' ' 7' ' ' LEU . 40.6 mt -142.49 146.86 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.892 . . . . 0.0 110.115 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.21 178.18 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.185 -0.947 . . . . 0.0 110.25 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.522 ' OG1' ' CE1' ' A' ' 6' ' ' HIS . 53.9 m -145.91 151.18 37.43 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.267 -0.896 . . . . 0.0 110.159 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.72 128.91 31.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -0.998 . . . . 0.0 110.091 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -97.91 134.51 40.94 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.301 -0.874 . . . . 0.0 110.642 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.5 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 54.8 m-85 -112.72 151.51 30.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.298 -0.876 . . . . 0.0 110.053 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -76.7 -8.52 57.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 110.622 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.8 p -169.55 160.94 9.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.05 -1.031 . . . . 0.0 110.561 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.2 -41.94 80.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.203 -0.936 . . . . 0.0 109.932 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.48 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 51.7 t-105 -53.51 -52.39 59.77 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 61.7 tt0 -58.74 -30.56 67.59 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.188 -0.945 . . . . 0.0 109.685 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.1 -48.97 79.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.392 -0.817 . . . . 0.0 110.557 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.537 ' OD1' ' N ' ' A' ' 61' ' ' GLN . 2.5 p30 -61.17 -26.54 67.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.087 -1.008 . . . . 0.0 110.315 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.537 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 67.1 mt-30 -65.95 -52.03 53.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.151 -0.968 . . . . 0.0 109.97 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.652 ' O ' HG22 ' A' ' 66' ' ' VAL . 5.7 t80 -55.53 -46.32 77.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 109.718 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.3 mt -59.75 -21.87 61.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.33 -0.856 . . . . 0.0 110.198 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.91 -17.56 29.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 110.076 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -94.65 -14.74 24.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.312 -0.867 . . . . 0.0 110.351 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 62' ' ' PHE . 20.1 m -130.37 134.81 61.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -0.908 . . . . 0.0 110.137 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.5 tptp -86.52 120.05 27.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.205 -0.934 . . . . 0.0 110.322 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.635 HD11 HG23 ' A' ' 66' ' ' VAL . 4.8 mm -88.96 103.6 5.94 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.967 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.73 ' CG ' HD12 ' A' ' 72' ' ' ILE . 46.0 Cg_endo -39.9 154.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.094 1.576 . . . . 0.0 110.418 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 70' ' ' LYS . 13.6 mtpp -70.35 -14.86 62.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 0.0 110.459 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -84.66 -19.32 33.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.361 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.73 HD12 ' CG ' ' A' ' 69' ' ' PRO . 23.8 mt -93.81 123.59 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.6 m -94.7 136.6 34.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.458 -0.776 . . . . 0.0 110.416 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.588 HG12 ' N ' ' A' ' 75' ' ' SER . 92.9 t -90.73 171.99 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.565 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.588 ' N ' HG12 ' A' ' 74' ' ' VAL . 0.4 OUTLIER -142.45 152.82 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.387 -0.821 . . . . 0.0 110.661 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' B' ' 80' ' ' SER . 63.5 p -132.97 135.4 45.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.273 -0.892 . . . . 0.0 110.15 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.502 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -174.39 -173.63 40.53 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.502 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 50.2 m-85 -147.65 151.56 36.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.167 -1.196 . . . . 0.0 110.399 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.408 ' CE ' ' CE ' ' B' ' 79' ' ' MET . 25.5 mtt -119.78 174.84 6.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.182 -0.949 . . . . 0.0 110.287 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.464 ' C ' HG13 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -140.69 108.72 5.73 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.324 -0.86 . . . . 0.0 109.836 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.464 HG13 ' C ' ' A' ' 80' ' ' SER . 23.3 mt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.23 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mtm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.226 0.536 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.5 122.17 61.64 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.161 -0.962 . . . . 0.0 110.44 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.494 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.5 Cg_endo -68.79 146.86 67.62 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.978 1.515 . . . . 0.0 110.071 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.41 ' CG1' ' O ' ' B' ' 4' ' ' ILE . 1.7 pp -144.12 117.22 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.118 -0.989 . . . . 0.0 110.297 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 53.6 t -94.06 152.63 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.268 -0.895 . . . . 0.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.589 ' CB ' ' HB2' ' B' ' 75' ' ' SER . 0.2 OUTLIER -134.45 117.75 16.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.938 179.9 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.654 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.0 OUTLIER -113.86 148.81 36.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.284 -179.791 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.513 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 16.5 tttm -142.59 168.34 19.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.513 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 151.12 -156.76 26.84 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 10' ' ' ASP . . . . . 0.402 ' HB2' ' OG1' ' B' ' 13' ' ' THR . 53.5 m-20 -64.98 127.31 31.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -1.188 . . . . 0.0 110.293 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.09 -26.86 4.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.299 -0.876 . . . . 0.0 110.088 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -77.6 -45.92 23.74 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.19 -0.944 . . . . 0.0 110.219 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.402 ' OG1' ' HB2' ' B' ' 10' ' ' ASP . 28.1 m -57.96 -21.13 42.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.26 -0.9 . . . . 0.0 110.089 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 1.007 ' HA ' HD12 ' B' ' 17' ' ' LEU . 31.7 mt -77.24 -29.79 54.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.247 -0.908 . . . . 0.0 110.246 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -60.13 -38.84 84.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.879 . . . . 0.0 110.582 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.7 t -70.02 -40.19 75.35 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.192 -0.943 . . . . 0.0 110.8 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 1.007 HD12 ' HA ' ' B' ' 14' ' ' LEU . 14.0 mt -58.86 -50.13 75.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.128 -0.982 . . . . 0.0 110.349 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.594 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 46.5 ttt-85 -44.8 -37.26 3.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.924 . . . . 0.0 110.767 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 87.7 t80 -64.97 -41.56 95.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.991 -1.068 . . . . 0.0 110.239 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 mtt180 -58.21 -36.6 73.37 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.212 -0.93 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.594 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 5.8 m-30 -66.54 -17.8 65.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 22' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.1 mmtt -63.39 -48.54 77.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.203 -0.936 . . . . 0.0 110.035 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -74.66 -23.81 58.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.264 -0.898 . . . . 0.0 109.638 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.826 ' HB3' HD12 ' B' ' 27' ' ' LEU . 3.6 m-70 -95.23 34.05 1.47 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.347 -0.846 . . . . 0.0 109.832 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.536 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.2 p -56.74 -24.84 52.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.309 -0.87 . . . . 0.0 110.015 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.685 HG23 ' O ' ' B' ' 26' ' ' THR . 14.0 t -96.71 54.06 1.29 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.35 -0.844 . . . . 0.0 109.77 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.826 HD12 ' HB3' ' B' ' 24' ' ' HIS . 12.3 mt -147.76 -32.02 0.28 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.335 -0.853 . . . . 0.0 110.788 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.536 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 9.1 p90 -108.38 167.53 9.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.864 -1.148 . . . . 0.0 110.04 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 18.9 m -100.54 -36.88 9.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.193 -0.942 . . . . 0.0 110.698 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.87 118.93 2.8 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.054 -1.029 . . . . 0.0 110.733 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -89.95 136.81 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.296 -0.877 . . . . 0.0 109.827 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.602 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 26.8 p -97.37 150.46 20.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.135 -0.978 . . . . 0.0 110.451 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.36 161.74 8.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.368 -0.833 . . . . 0.0 110.43 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -68.15 127.55 33.31 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 110.365 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.599 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 39.8 p-90 -146.26 -179.97 7.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.66 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.575 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 27.5 t-80 -162.57 174.37 12.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.931 -1.105 . . . . 0.0 110.67 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.575 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 57.1 m95 -78.6 93.54 4.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.484 -0.76 . . . . 0.0 109.806 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 13.9 t . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.27 -0.894 . . . . 0.0 110.333 -179.698 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.475 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 121.359 0.599 . . . . 0.0 110.66 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.654 HG23 ' O ' ' B' ' 7' ' ' LEU . 38.7 mt -142.75 147.24 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 110.125 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.95 178.26 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.219 -0.926 . . . . 0.0 110.281 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.548 ' OG1' ' CE1' ' B' ' 6' ' ' HIS . 53.1 m -145.96 151.75 38.3 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.246 -0.909 . . . . 0.0 110.105 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.08 129.12 31.4 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.159 -0.963 . . . . 0.0 110.061 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 7.3 m -97.95 134.58 40.87 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.28 -0.888 . . . . 0.0 110.602 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.5 ' OH ' ' CG ' ' B' ' 62' ' ' PHE . 52.8 m-85 -112.84 151.6 30.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.315 -0.865 . . . . 0.0 110.065 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -76.31 -9.2 58.46 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.191 -0.943 . . . . 0.0 110.637 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 26.1 p -169.51 160.19 8.95 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.186 -0.946 . . . . 0.0 110.468 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.81 -42.15 86.37 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.196 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 57' ' ' TRP . . . . . 0.482 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 50.4 t-105 -53.53 -52.34 59.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.243 -0.911 . . . . 0.0 109.669 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 63.1 tt0 -58.85 -30.11 67.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.243 -0.911 . . . . 0.0 109.721 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.29 -49.18 78.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 110.464 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' B' ' 61' ' ' GLN . 2.3 p30 -61.18 -26.61 67.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.093 -1.005 . . . . 0.0 110.36 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.53 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 67.2 mt-30 -65.86 -52.09 53.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.19 -0.944 . . . . 0.0 109.851 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.661 ' O ' HG22 ' B' ' 66' ' ' VAL . 5.3 t80 -55.47 -46.3 76.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.824 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.2 mt -59.59 -22.07 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.0 110.136 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.71 -17.62 29.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.146 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -94.68 -13.96 25.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.293 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.661 HG22 ' O ' ' B' ' 62' ' ' PHE . 22.0 m -131.01 134.63 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.188 -0.945 . . . . 0.0 110.181 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -86.3 120.03 27.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.626 HD11 HG23 ' B' ' 66' ' ' VAL . 4.9 mm -89.02 103.76 6.3 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.979 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.783 ' CG ' HD12 ' B' ' 72' ' ' ILE . 45.8 Cg_endo -40.38 154.5 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.076 1.566 . . . . 0.0 110.495 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -70.5 -14.76 62.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.886 . . . . 0.0 110.486 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 28.4 m -84.58 -19.05 33.7 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.154 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.783 HD12 ' CG ' ' B' ' 69' ' ' PRO . 27.1 mt -94.32 123.71 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.33 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 24.3 m -94.8 136.64 34.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.38 -0.825 . . . . 0.0 110.495 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.595 HG12 ' N ' ' B' ' 75' ' ' SER . 99.4 t -90.79 172.07 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.264 -0.898 . . . . 0.0 110.602 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 75' ' ' SER . . . . . 0.595 ' N ' HG12 ' B' ' 74' ' ' VAL . 0.4 OUTLIER -142.29 153.56 44.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.358 -0.839 . . . . 0.0 110.658 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 76' ' ' THR . . . . . 0.436 ' O ' ' HB3' ' A' ' 80' ' ' SER . 52.5 p -133.56 135.74 44.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.529 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -174.61 -173.61 40.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.529 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 48.9 m-85 -147.81 149.92 33.24 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -1.117 . . . . 0.0 110.33 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.408 ' CE ' ' CE ' ' A' ' 79' ' ' MET . 26.0 mtt -118.69 173.22 6.98 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.226 -0.921 . . . . 0.0 110.351 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.477 ' C ' HG13 ' B' ' 81' ' ' ILE . 0.1 OUTLIER -139.43 107.95 5.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 110.086 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.477 HG13 ' C ' ' B' ' 80' ' ' SER . 29.7 mt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.169 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.4 mmm . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.327 0.584 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.572 ' O ' HG23 ' A' ' 2' ' ' THR . 14.8 t -88.42 125.96 61.84 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.903 . . . . 0.0 110.413 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.55 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -63.45 152.29 80.81 Favored 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 124.124 1.592 . . . . 0.0 110.209 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.418 ' C ' HG23 ' A' ' 5' ' ' VAL . 11.1 pt -144.16 164.04 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.211 -0.931 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.418 HG23 ' C ' ' A' ' 4' ' ' ILE . 41.3 t -146.14 136.88 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.159 -0.963 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.604 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.0 OUTLIER -105.2 131.38 52.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 109.599 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.508 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.4 OUTLIER -122.45 139.66 53.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.139 -0.976 . . . . 0.0 110.771 -179.407 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 80.6 tttt -142.3 170.85 14.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 110.164 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.499 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.44 -160.55 29.28 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.619 -1.393 . . . . 0.0 109.619 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.469 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 47.0 t0 -64.86 130.54 43.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -1.143 . . . . 0.0 110.336 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.1 -30.77 11.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.302 -0.873 . . . . 0.0 110.464 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -83.61 -48.39 10.26 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.263 -0.898 . . . . 0.0 110.527 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' A' ' 10' ' ' ASP . 91.7 m -57.88 -14.96 7.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 110.494 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.603 HD23 HD12 ' A' ' 17' ' ' LEU . 64.2 mt -82.48 -32.42 28.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 110.309 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -59.23 -36.62 75.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.239 -0.913 . . . . 0.0 110.031 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.7 t -70.11 -34.67 73.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.288 -0.883 . . . . 0.0 110.048 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.603 HD12 HD23 ' A' ' 14' ' ' LEU . 13.3 mt -58.77 -50.62 73.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.917 . . . . 0.0 109.939 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.575 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 34.5 ttt180 -46.23 -30.65 2.09 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.283 -0.885 . . . . 0.0 109.883 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 28.2 t80 -65.01 -46.55 80.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.399 -0.813 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -34.29 73.63 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.225 -0.922 . . . . 0.0 110.316 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.575 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.5 m-30 -66.38 -22.6 66.25 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 110.377 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 29.5 mmtt -63.62 -29.93 71.11 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.244 -0.91 . . . . 0.0 110.336 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -74.84 -47.75 28.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.5 ' HB3' HD22 ' A' ' 27' ' ' LEU . 16.0 m-70 -95.15 41.3 1.1 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.869 . . . . 0.0 109.965 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.578 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 24.5 p -56.8 -19.15 15.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 110.19 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 26' ' ' THR . 89.7 m -97.17 6.43 48.48 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.327 -0.858 . . . . 0.0 110.284 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -92.19 -7.67 47.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.291 -0.88 . . . . 0.0 110.187 -179.754 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.578 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 7.3 p90 -141.7 -176.76 4.88 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.027 -179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.432 HG22 ' N ' ' A' ' 30' ' ' ALA . 1.3 m -94.84 -62.83 1.25 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.921 . . . . 0.0 109.191 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.432 ' N ' HG22 ' A' ' 29' ' ' THR . . . -157.18 143.86 18.25 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.929 -1.107 . . . . 0.0 108.72 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.616 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.7 p -90.02 110.76 22.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.9 0 O-C-N 121.639 -0.663 . . . . 0.0 110.325 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.587 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -53.24 146.15 12.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.213 -0.929 . . . . 0.0 110.009 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.55 ' HB2' ' CG2' ' B' ' 38' ' ' THR . 7.0 t -60.9 160.82 9.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 m -67.75 122.07 17.31 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.525 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.591 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 25.4 p-90 -147.1 166.7 26.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 109.83 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.474 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 36.6 t60 -162.58 -173.52 3.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.042 -1.036 . . . . 0.0 110.779 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.433 ' H ' ' CD2' ' A' ' 36' ' ' HIS . 19.4 m95 -79.53 101.67 8.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.501 -0.75 . . . . 0.0 110.379 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.54 ' CG2' ' HB2' ' B' ' 33' ' ' SER . 1.7 t . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.401 -0.812 . . . . 0.0 110.017 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.219 0.533 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.508 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.7 mt -140.55 155.6 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.275 -0.891 . . . . 0.0 110.297 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.9 t -138.75 118.47 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.385 -0.822 . . . . 0.0 110.394 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 86.9 m -94.3 158.13 15.72 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.251 -0.905 . . . . 0.0 110.314 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.97 134.24 38.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.274 -0.892 . . . . 0.0 110.112 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.38 123.94 40.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.228 -0.92 . . . . 0.0 110.341 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.55 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 58.5 m-85 -103.32 146.83 27.88 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.351 -0.843 . . . . 0.0 109.85 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.09 -8.25 58.81 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.203 -0.935 . . . . 0.0 110.658 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.9 p -171.15 134.11 0.9 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.961 . . . . 0.0 110.374 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.518 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 44.4 mt-10 -50.08 -37.54 34.16 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.249 -0.907 . . . . 0.0 109.988 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 35.5 t-105 -53.83 -58.87 5.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.076 -1.015 . . . . 0.0 109.799 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -58.47 -28.74 65.62 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.161 -0.962 . . . . 0.0 110.337 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.518 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 53.6 ttp180 -59.56 -48.38 81.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.154 -0.967 . . . . 0.0 110.984 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.601 ' HA ' HD21 ' A' ' 63' ' ' LEU . 1.1 p30 -60.93 -33.67 73.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.093 -1.004 . . . . 0.0 110.741 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.519 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 57.5 mt-30 -65.65 -47.57 75.12 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.148 -0.97 . . . . 0.0 110.271 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.545 ' HA ' HD23 ' A' ' 27' ' ' LEU . 36.2 t80 -55.8 -65.24 0.63 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.38 -0.825 . . . . 0.0 110.664 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 60' ' ' ASP . 3.0 pp -59.39 -18.33 37.88 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 3.6 t -81.84 -20.68 38.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 0.0 110.128 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.52 -73.03 0.6 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.273 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 62' ' ' PHE . 34.3 m -48.14 130.18 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.113 -0.992 . . . . 0.0 109.992 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.7 108.43 6.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.179 -0.95 . . . . 0.0 110.492 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 30.9 mt -89.21 121.37 69.54 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.377 -0.827 . . . . 0.0 110.09 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -56.26 179.01 0.1 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 123.899 1.473 . . . . 0.0 110.528 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -92.19 -12.43 32.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 110.133 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.3 m -84.62 -16.69 41.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.249 -0.907 . . . . 0.0 110.305 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.522 ' CD1' ' N ' ' A' ' 72' ' ' ILE . 1.2 mp -94.06 119.39 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.243 -0.911 . . . . 0.0 110.041 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.56 139.75 30.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.32 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.55 HG22 ' N ' ' A' ' 75' ' ' SER . 8.4 p -90.71 170.54 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.245 -0.909 . . . . 0.0 110.46 -179.335 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.616 ' OG ' HG22 ' B' ' 81' ' ' ILE . 0.2 OUTLIER -143.85 158.84 43.42 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.345 -0.847 . . . . 0.0 110.988 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.7 p -133.37 134.19 43.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.39 -0.819 . . . . 0.0 109.854 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -167.75 -168.22 29.56 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -147.78 149.15 31.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.232 -1.158 . . . . 0.0 110.334 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 24.5 mmm -124.75 154.48 40.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 110.092 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.516 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.7 OUTLIER -130.23 103.86 6.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -0.963 . . . . 0.0 110.394 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.565 HG22 ' OG ' ' B' ' 75' ' ' SER . 13.2 pt . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.194 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.6 mmm . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.173 0.511 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 2' ' ' THR . . . . . 0.576 ' O ' HG23 ' B' ' 2' ' ' THR . 14.7 t -88.65 125.42 63.14 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.269 -0.894 . . . . 0.0 110.48 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.548 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.1 Cg_endo -63.35 152.27 80.78 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.051 1.553 . . . . 0.0 110.408 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.436 ' C ' HG23 ' B' ' 5' ' ' VAL . 10.3 pt -144.12 164.39 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.232 -0.918 . . . . 0.0 110.397 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.436 HG23 ' C ' ' B' ' 4' ' ' ILE . 41.5 t -146.32 137.27 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.269 -0.895 . . . . 0.0 110.437 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.618 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.0 OUTLIER -105.4 131.0 53.37 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.349 -0.844 . . . . 0.0 109.582 179.585 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.501 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.4 OUTLIER -122.22 139.85 53.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.065 -1.022 . . . . 0.0 110.703 -179.408 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.491 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 80.5 tttt -142.35 170.43 15.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 110.176 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.491 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.81 -160.5 29.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 10' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 45.8 t0 -64.94 130.98 45.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -1.139 . . . . 0.0 110.372 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.33 -30.93 13.18 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.311 -0.868 . . . . 0.0 110.388 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -83.92 -48.25 10.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.264 -0.898 . . . . 0.0 110.508 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' B' ' 10' ' ' ASP . 99.2 m -57.78 -14.57 6.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.597 HD23 HD12 ' B' ' 17' ' ' LEU . 70.4 mt -83.04 -32.22 26.99 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.313 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -59.53 -35.91 75.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.156 -0.965 . . . . 0.0 110.065 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.447 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.7 t -70.46 -34.82 72.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.198 -0.939 . . . . 0.0 110.108 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.597 HD12 HD23 ' B' ' 14' ' ' LEU . 13.6 mt -58.84 -50.77 72.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 0.0 110.164 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.588 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 33.1 ttt180 -46.29 -30.19 1.95 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.293 -0.88 . . . . 0.0 109.903 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.473 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 30.0 t80 -65.06 -47.3 77.8 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.405 -0.809 . . . . 0.0 110.319 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.71 -33.9 72.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.209 -0.932 . . . . 0.0 110.27 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.588 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.4 m-30 -66.72 -22.87 66.05 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.0 110.293 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 22' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.7 mmtt -63.37 -30.02 71.22 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.95 . . . . 0.0 110.412 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -74.92 -48.04 26.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.195 -0.941 . . . . 0.0 110.052 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.515 ' HB3' ' HB2' ' B' ' 27' ' ' LEU . 15.8 m-70 -94.82 41.63 1.09 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.269 -0.894 . . . . 0.0 110.063 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.566 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 25.2 p -57.04 -18.87 15.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.336 -0.853 . . . . 0.0 110.14 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.512 HG22 ' O ' ' B' ' 26' ' ' THR . 86.8 m -97.27 6.11 48.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.858 . . . . 0.0 110.199 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' B' ' 62' ' ' PHE . 0.7 OUTLIER -92.26 -6.2 50.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.224 -0.922 . . . . 0.0 110.324 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.566 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 7.6 p90 -143.29 -177.1 5.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.372 -0.83 . . . . 0.0 109.836 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.442 HG22 ' N ' ' B' ' 30' ' ' ALA . 1.3 m -94.8 -63.23 1.2 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.244 -0.91 . . . . 0.0 109.214 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.442 ' N ' HG22 ' B' ' 29' ' ' THR . . . -156.8 143.09 18.17 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 120.985 -1.072 . . . . 0.0 108.625 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.594 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.5 p -89.95 110.77 22.29 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 110.268 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.591 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -52.7 145.84 11.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.4 -0.812 . . . . 0.0 110.195 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 33' ' ' SER . . . . . 0.54 ' HB2' ' CG2' ' A' ' 38' ' ' THR . 6.8 t -60.66 160.86 8.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.284 -0.885 . . . . 0.0 110.102 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -67.99 122.73 18.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -0.901 . . . . 0.0 110.38 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.587 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 26.1 p-90 -147.76 167.02 25.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.618 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.478 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 37.1 t60 -162.61 -173.66 3.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.019 -1.051 . . . . 0.0 110.815 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.447 ' H ' ' CD2' ' B' ' 36' ' ' HIS . 19.9 m95 -79.43 100.79 7.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.535 -0.728 . . . . 0.0 110.379 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 38' ' ' THR . . . . . 0.55 ' CG2' ' HB2' ' A' ' 33' ' ' SER . 1.4 t . . . . . 0 N--CA 1.494 1.738 0 O-C-N 121.388 -0.82 . . . . 0.0 110.241 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.179 0.514 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.501 HG23 ' O ' ' B' ' 7' ' ' LEU . 2.5 mt -140.49 155.75 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 110.338 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 62.1 t -138.57 117.89 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.467 ' HG1' ' CE1' ' B' ' 6' ' ' HIS . 93.9 m -93.77 158.49 15.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.208 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.33 134.42 37.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.973 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.5 124.63 40.55 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.223 -0.923 . . . . 0.0 110.47 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.548 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -104.09 146.79 28.22 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.335 -0.853 . . . . 0.0 109.887 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -79.17 -8.23 58.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.16 -0.963 . . . . 0.0 110.487 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 84.3 p -170.71 135.01 1.09 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.203 -0.935 . . . . 0.0 110.252 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.522 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 42.9 mt-10 -51.17 -37.43 46.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.965 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 57' ' ' TRP . . . . . 0.481 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 35.3 t-105 -53.82 -58.57 6.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.124 -0.985 . . . . 0.0 109.81 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -58.78 -28.54 66.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.173 -0.954 . . . . 0.0 110.327 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.522 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 54.0 ttp180 -59.47 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.143 -0.973 . . . . 0.0 110.853 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.605 ' HA ' HD21 ' B' ' 63' ' ' LEU . 1.1 p30 -61.04 -33.76 73.79 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.056 -1.027 . . . . 0.0 110.785 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.516 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 56.7 mt-30 -65.78 -47.26 75.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.062 -1.024 . . . . 0.0 110.122 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.55 ' HA ' HD23 ' B' ' 27' ' ' LEU . 37.2 t80 -55.88 -65.49 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 110.646 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' B' ' 60' ' ' ASP . 2.9 pp -59.13 -18.85 39.47 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.352 -0.842 . . . . 0.0 110.426 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 3.3 t -81.54 -20.32 40.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.127 -0.983 . . . . 0.0 110.171 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.68 -73.5 0.59 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.105 -0.997 . . . . 0.0 110.244 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.51 HG22 ' O ' ' B' ' 62' ' ' PHE . 34.0 m -47.54 130.17 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.212 -0.93 . . . . 0.0 109.937 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.53 108.7 6.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.173 -0.954 . . . . 0.0 110.426 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 25.1 mt -89.47 121.89 68.86 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.011 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.418 ' HG2' HD13 ' B' ' 72' ' ' ILE . 47.1 Cg_endo -57.0 178.55 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 123.968 1.509 . . . . 0.0 110.557 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -91.75 -12.34 34.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.206 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.1 m -84.76 -16.79 40.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.212 -0.93 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.52 ' CD1' ' N ' ' B' ' 72' ' ' ILE . 1.2 mp -93.96 119.14 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.147 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.43 139.69 30.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.328 -0.857 . . . . 0.0 110.175 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.56 HG22 ' N ' ' B' ' 75' ' ' SER . 8.4 p -90.6 170.69 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 110.518 -179.383 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 75' ' ' SER . . . . . 0.618 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.87 158.53 43.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.432 -0.792 . . . . 0.0 111.008 179.823 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 82.8 p -133.34 134.21 43.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.453 -0.779 . . . . 0.0 109.97 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -168.21 -167.84 29.45 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -147.81 149.45 32.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.1 -1.235 . . . . 0.0 110.507 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.425 ' HE3' HG23 ' B' ' 81' ' ' ILE . 24.1 mmm -125.09 153.18 43.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.169 -0.957 . . . . 0.0 110.017 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.518 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.7 OUTLIER -128.89 104.41 7.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.211 -0.931 . . . . 0.0 110.24 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.616 HG22 ' OG ' ' A' ' 75' ' ' SER . 13.7 pt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.181 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 mtm . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.171 0.51 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -94.72 118.09 66.85 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.175 -0.953 . . . . 0.0 110.15 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 50.6 Cg_endo -53.54 147.0 40.37 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.093 1.575 . . . . 0.0 110.411 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.446 HG23 ' O ' ' A' ' 2' ' ' THR . 1.1 pt -143.06 109.93 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.34 -0.85 . . . . 0.0 110.024 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.95 153.92 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 110.424 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.6 ' CE1' ' OG1' ' A' ' 50' ' ' THR . 0.1 OUTLIER -134.71 117.14 15.7 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.372 -0.83 . . . . 0.0 109.821 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.55 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.8 OUTLIER -112.74 145.36 40.68 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 -179.716 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 72' ' ' ILE . 20.4 tttm -143.42 169.8 16.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.265 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.79 -157.35 27.24 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.481 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 81.9 m-20 -64.79 123.5 19.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.179 -1.189 . . . . 0.0 109.948 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.806 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.77 -43.94 48.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.842 . . . . 0.0 110.632 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.42 -48.22 82.68 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.241 -0.912 . . . . 0.0 110.451 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.4 m -57.96 -28.19 64.12 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.301 -0.874 . . . . 0.0 110.419 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.806 HD12 ' HA ' ' A' ' 11' ' ' ALA . 97.5 mt -65.69 -30.03 70.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.214 -0.929 . . . . 0.0 110.042 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.1 -36.92 78.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.32 -0.862 . . . . 0.0 110.147 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.548 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 4.6 t -70.06 -40.56 75.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 110.762 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.405 HD11 ' CD1' ' A' ' 72' ' ' ILE . 1.0 OUTLIER -58.75 -52.03 67.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.973 -1.079 . . . . 0.0 110.188 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.527 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 7.3 ttt-85 -48.31 -27.6 2.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.886 . . . . 0.0 110.258 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.548 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 64.6 t80 -64.65 -25.74 68.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.224 -0.922 . . . . 0.0 110.074 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -83.55 -25.33 31.07 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.228 -0.92 . . . . 0.0 109.919 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.565 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.2 m-30 -66.5 -22.62 66.18 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.387 -0.821 . . . . 0.0 110.439 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -63.32 -47.35 82.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.06 -20.26 59.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.189 -0.944 . . . . 0.0 109.839 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.895 ' HB3' HD12 ' A' ' 27' ' ' LEU . 20.8 m170 -95.42 39.67 1.12 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 110.161 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.493 ' SG ' ' N ' ' A' ' 26' ' ' THR . 19.3 p -57.06 -36.2 70.24 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.11 -0.994 . . . . 0.0 110.368 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.551 ' O ' HG23 ' A' ' 26' ' ' THR . 8.7 t -97.27 67.04 2.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.134 -0.979 . . . . 0.0 110.543 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.895 HD12 ' HB3' ' A' ' 24' ' ' HIS . 10.0 mt -148.11 -43.95 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.258 -0.901 . . . . 0.0 110.074 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -107.11 170.25 8.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.208 -0.932 . . . . 0.0 109.725 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.445 HG23 ' OD2' ' A' ' 54' ' ' ASP . 0.2 OUTLIER -100.34 -33.84 10.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.087 -1.008 . . . . 0.0 111.046 -179.348 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.417 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -159.73 116.82 2.6 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.097 . . . . 0.0 110.924 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.46 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.4 p -90.03 131.33 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 110.019 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.582 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 53.8 p -86.02 149.23 25.31 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.251 -0.905 . . . . 0.0 110.302 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.0 t -61.36 161.58 9.01 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.142 -0.974 . . . . 0.0 110.013 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.87 128.37 36.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.326 -0.859 . . . . 0.0 110.406 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 36.6 p-90 -146.36 -179.25 6.62 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.294 -0.879 . . . . 0.0 109.77 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.553 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 32.8 t60 -162.56 169.71 19.79 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.1 -1.0 . . . . 0.0 110.208 -179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.553 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 56.4 m95 -79.07 110.01 13.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.212 -0.93 . . . . 0.0 110.159 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.274 -0.891 . . . . 0.0 110.183 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.502 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.72 0 CA-C-O 121.293 0.568 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.55 HG23 ' O ' ' A' ' 7' ' ' LEU . 10.0 mt -142.48 157.71 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.226 -0.921 . . . . 0.0 109.915 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.522 HG13 ' N ' ' A' ' 50' ' ' THR . 0.4 OUTLIER -139.0 179.51 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.154 -0.966 . . . . 0.0 110.521 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.6 ' OG1' ' CE1' ' A' ' 6' ' ' HIS . 49.2 m -145.65 153.77 41.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.391 -0.818 . . . . 0.0 109.571 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.91 128.79 35.28 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.034 -1.042 . . . . 0.0 110.342 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -96.98 127.13 42.64 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.368 -0.833 . . . . 0.0 110.168 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.536 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 53.8 m-85 -106.85 147.79 29.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.31 -0.869 . . . . 0.0 110.064 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.445 ' OD2' HG23 ' A' ' 29' ' ' THR . 0.3 OUTLIER -71.44 -6.02 37.2 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.847 . . . . 0.0 110.773 -179.602 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 p -175.84 174.51 2.15 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -1.0 . . . . 0.0 110.594 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.98 -44.98 45.18 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.317 -0.865 . . . . 0.0 110.353 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.505 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 67.0 t-105 -53.62 -50.09 66.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.175 -0.953 . . . . 0.0 109.916 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 53.9 tt0 -57.08 -39.56 75.21 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 110.586 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.488 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 6.4 ttp180 -59.26 -40.67 86.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.98 -1.075 . . . . 0.0 110.643 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.505 ' OD2' ' O ' ' A' ' 57' ' ' TRP . 0.0 OUTLIER -61.45 -39.61 91.48 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.096 -1.003 . . . . 0.0 110.749 -179.429 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 23.1 mt-30 -65.4 -44.12 88.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.226 -0.921 . . . . 0.0 110.481 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.754 ' O ' HG22 ' A' ' 66' ' ' VAL . 86.2 t80 -55.3 -42.01 73.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.179 -0.951 . . . . 0.0 110.119 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.5 mt -59.61 -13.24 8.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.7 p -98.83 -14.87 19.47 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.194 -0.941 . . . . 0.0 110.423 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 4.5 mm-40 -96.48 -12.65 23.87 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.173 -0.954 . . . . 0.0 109.992 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.754 HG22 ' O ' ' A' ' 62' ' ' PHE . 13.8 m -133.22 105.21 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.302 -0.874 . . . . 0.0 110.084 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -62.37 123.66 18.84 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 110.398 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.43 ' HA ' HD13 ' A' ' 68' ' ' ILE . 25.3 mm -88.95 113.45 56.1 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.293 -0.88 . . . . 0.0 110.266 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.462 ' HG2' ' CG1' ' A' ' 72' ' ' ILE . 44.3 Cg_endo -56.61 152.33 41.72 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.042 1.548 . . . . 0.0 110.499 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -68.75 -11.85 60.79 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.275 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.2 m -84.64 -24.89 28.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.198 -0.939 . . . . 0.0 109.974 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.471 HG23 ' O ' ' A' ' 8' ' ' LYS . 12.3 mt -94.12 123.45 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.466 -0.771 . . . . 0.0 110.148 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -94.48 138.0 32.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.23 -0.919 . . . . 0.0 110.023 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -91.26 172.59 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.204 -0.935 . . . . 0.0 110.574 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.549 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.89 155.41 44.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.566 -0.708 . . . . 0.0 110.381 179.524 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.482 ' O ' ' HB3' ' B' ' 80' ' ' SER . 0.6 OUTLIER -133.19 136.13 45.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 110.186 179.26 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.41 ' O ' HG13 ' A' ' 4' ' ' ILE . . . -176.39 -172.33 40.98 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.446 ' HA ' HG12 ' A' ' 4' ' ' ILE . 97.7 m-85 -148.14 155.18 41.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.09 -1.241 . . . . 0.0 110.64 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' B' ' 79' ' ' MET . 27.2 mtt -123.64 174.79 7.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.333 -0.855 . . . . 0.0 110.168 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.488 ' C ' ' CG1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -139.08 109.19 6.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 110.085 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.488 ' CG1' ' C ' ' A' ' 80' ' ' SER . 10.8 mt . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.173 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.1 mtm . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.276 0.56 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 2' ' ' THR . . . . . 0.43 ' O ' HG23 ' B' ' 4' ' ' ILE . 0.0 OUTLIER -94.07 118.07 67.19 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.319 -0.863 . . . . 0.0 110.078 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 49.8 Cg_endo -53.9 147.61 41.42 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.942 1.496 . . . . 0.0 110.496 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.434 HG12 ' CA ' ' B' ' 78' ' ' PHE . 1.1 pt -142.95 109.52 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.984 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -93.8 153.13 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.306 -0.871 . . . . 0.0 110.271 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.552 ' CE1' ' OG1' ' B' ' 50' ' ' THR . 0.1 OUTLIER -134.13 117.17 16.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.332 -0.855 . . . . 0.0 109.952 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.565 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.8 OUTLIER -112.87 145.5 40.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.178 -0.951 . . . . 0.0 110.33 -179.785 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.468 ' O ' HG23 ' B' ' 72' ' ' ILE . 19.9 tttm -143.46 169.76 17.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.294 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.71 -157.38 27.26 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 81.8 m-20 -64.57 123.1 18.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.18 -1.188 . . . . 0.0 110.041 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.807 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.9 -43.24 49.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.297 -0.877 . . . . 0.0 110.571 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -60.48 -48.33 82.22 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.194 -0.941 . . . . 0.0 110.358 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.9 m -58.31 -28.42 65.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.452 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' B' ' 11' ' ' ALA . 94.3 mt -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.905 . . . . 0.0 110.145 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -60.12 -36.96 78.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.3 -0.875 . . . . 0.0 110.19 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 4.7 t -70.0 -40.55 75.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 110.64 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.41 HD11 ' CD1' ' B' ' 72' ' ' ILE . 1.0 OUTLIER -58.83 -51.81 68.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.014 -1.054 . . . . 0.0 110.252 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.521 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 7.3 ttt-85 -48.29 -27.4 2.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.37 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.547 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 65.4 t80 -64.6 -26.33 68.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.277 -0.889 . . . . 0.0 110.15 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -82.89 -25.27 32.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.915 . . . . 0.0 109.943 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.575 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.3 m-30 -66.46 -23.04 66.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.359 -0.838 . . . . 0.0 110.425 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -63.21 -47.01 84.35 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.25 -0.906 . . . . 0.0 110.304 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.11 -20.71 59.31 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.179 -0.951 . . . . 0.0 109.859 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.899 ' HB3' HD12 ' B' ' 27' ' ' LEU . 20.7 m170 -95.11 40.01 1.11 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.462 -0.773 . . . . 0.0 110.072 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' B' ' 26' ' ' THR . 18.5 p -57.3 -36.49 71.13 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.91 . . . . 0.0 110.354 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.527 HG23 ' O ' ' B' ' 26' ' ' THR . 7.0 t -97.21 67.05 2.13 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.149 -0.969 . . . . 0.0 110.582 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.899 HD12 ' HB3' ' B' ' 24' ' ' HIS . 10.1 mt -148.16 -44.38 0.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.204 -0.935 . . . . 0.0 110.049 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -106.49 170.31 8.0 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.204 -0.935 . . . . 0.0 109.763 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.444 HG23 ' OD2' ' B' ' 54' ' ' ASP . 0.2 OUTLIER -100.26 -33.95 10.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.021 -1.05 . . . . 0.0 111.005 -179.314 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.401 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -159.67 116.91 2.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.991 -1.068 . . . . 0.0 110.866 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.479 ' O ' HG13 ' B' ' 31' ' ' VAL . 6.9 p -90.11 130.1 39.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.262 -0.899 . . . . 0.0 109.935 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.58 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 57.6 p -84.58 149.37 25.92 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.223 -0.923 . . . . 0.0 110.295 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -61.45 162.22 8.34 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.088 -1.008 . . . . 0.0 110.219 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.98 127.85 34.36 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.896 . . . . 0.0 110.269 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.582 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 37.9 p-90 -146.14 -178.92 6.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.22 -0.925 . . . . 0.0 109.882 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.551 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 34.0 t60 -162.56 169.38 20.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.054 -1.029 . . . . 0.0 110.414 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.551 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 58.1 m95 -79.07 110.15 14.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 109.903 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.225 -179.818 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.503 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.169 0.509 . . . . 0.0 110.621 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.565 HG23 ' O ' ' B' ' 7' ' ' LEU . 9.2 mt -142.65 157.95 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.345 -0.847 . . . . 0.0 109.963 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 49' ' ' VAL . . . . . 0.532 HG13 ' N ' ' B' ' 50' ' ' THR . 0.4 OUTLIER -139.14 179.95 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.123 -0.985 . . . . 0.0 110.637 -179.751 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.552 ' OG1' ' CE1' ' B' ' 6' ' ' HIS . 54.5 m -145.9 153.07 40.44 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 109.811 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.3 128.84 36.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.166 -0.959 . . . . 0.0 110.464 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 4.7 m -97.12 126.92 42.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.371 -0.83 . . . . 0.0 110.246 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.522 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 56.6 m-85 -106.87 148.17 28.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.258 -0.901 . . . . 0.0 110.013 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.444 ' OD2' HG23 ' B' ' 29' ' ' THR . 0.3 OUTLIER -72.15 -6.41 42.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.805 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 p -174.81 174.89 2.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.064 -1.023 . . . . 0.0 110.264 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -75.91 -44.14 41.75 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 67.0 t-105 -53.64 -49.95 66.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.881 . . . . 0.0 110.197 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.0 tt0 -57.3 -39.39 75.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.22 -0.925 . . . . 0.0 110.645 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.467 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 6.3 ttp180 -59.29 -41.35 88.75 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.138 -0.976 . . . . 0.0 110.714 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.485 ' OD2' ' O ' ' B' ' 57' ' ' TRP . 0.0 OUTLIER -61.19 -39.18 89.22 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.124 -0.985 . . . . 0.0 110.741 -179.386 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 23.3 mt-30 -65.42 -44.24 87.97 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.089 -1.007 . . . . 0.0 110.437 -179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.745 ' O ' HG22 ' B' ' 66' ' ' VAL . 83.7 t80 -55.28 -41.8 72.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.137 -0.977 . . . . 0.0 109.935 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.0 mt -59.68 -12.56 7.18 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.246 -0.909 . . . . 0.0 110.176 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 12.3 p -99.5 -14.79 18.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.228 -0.92 . . . . 0.0 110.488 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 65' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' B' ' 61' ' ' GLN . 4.5 mm-40 -96.45 -12.68 23.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 110.113 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.745 HG22 ' O ' ' B' ' 62' ' ' PHE . 13.1 m -133.26 104.65 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.351 -0.843 . . . . 0.0 110.171 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.6 tptp -62.0 123.86 19.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.428 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.421 ' HA ' HD13 ' B' ' 68' ' ' ILE . 25.3 mm -88.95 113.42 55.98 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.288 -0.883 . . . . 0.0 110.298 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.473 ' HG2' ' CG1' ' B' ' 72' ' ' ILE . 45.0 Cg_endo -56.4 152.6 38.73 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.957 1.504 . . . . 0.0 110.423 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -69.29 -11.86 61.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.219 -0.926 . . . . 0.0 110.29 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 10.7 m -84.48 -24.63 29.35 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.252 -0.905 . . . . 0.0 109.882 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.473 ' CG1' ' HG2' ' B' ' 69' ' ' PRO . 12.2 mt -94.37 123.41 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.275 -0.89 . . . . 0.0 110.267 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 99.1 m -94.53 138.07 32.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.163 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.424 ' H ' HG23 ' B' ' 74' ' ' VAL . 1.7 t -91.32 172.49 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 75' ' ' SER . . . . . 0.536 ' HB3' ' HB2' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -143.09 155.65 44.65 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.517 -0.74 . . . . 0.0 110.346 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 76' ' ' THR . . . . . 0.458 ' O ' ' HB3' ' A' ' 80' ' ' SER . 0.6 OUTLIER -133.41 135.63 44.74 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.18 -0.95 . . . . 0.0 110.203 179.361 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.405 ' O ' HG13 ' B' ' 4' ' ' ILE . . . -175.35 -172.21 40.03 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.434 ' CA ' HG12 ' B' ' 4' ' ' ILE . 97.7 m-85 -147.98 155.12 41.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.109 -1.23 . . . . 0.0 110.524 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' A' ' 79' ' ' MET . 27.4 mtt -123.98 173.75 8.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.405 -0.809 . . . . 0.0 110.052 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.487 ' C ' ' CG1' ' B' ' 81' ' ' ILE . 0.0 OUTLIER -138.23 109.14 6.71 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.19 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.487 ' CG1' ' C ' ' B' ' 80' ' ' SER . 10.4 mt . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.108 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' A' ' 2' ' ' THR . 70.1 mtm . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.213 0.53 . . . . 0.0 110.176 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' A' ' 1' ' ' MET . 76.7 m -43.71 105.23 0.42 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 46.5 Cg_endo -56.42 157.65 17.77 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 O-C-N 124.15 1.605 . . . . 0.0 110.743 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.541 HG22 HG22 ' A' ' 52' ' ' THR . 2.5 pp -144.09 168.28 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.37 -0.832 . . . . 0.0 109.947 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.521 ' O ' HG13 ' A' ' 5' ' ' VAL . 8.8 p -146.11 129.82 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.949 . . . . 0.0 110.544 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.564 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.1 OUTLIER -106.35 122.94 47.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.203 -0.936 . . . . 0.0 110.072 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.811 ' O ' HG23 ' A' ' 48' ' ' ILE . 11.8 mt -114.36 146.87 40.01 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.179 -0.951 . . . . 0.0 110.127 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.511 ' HB2' HG12 ' A' ' 48' ' ' ILE . 31.9 ttpt -141.43 165.58 27.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.186 -0.946 . . . . 0.0 110.721 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.42 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 154.28 -168.11 32.5 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.454 ' O ' ' HB ' ' A' ' 13' ' ' THR . 9.3 m-20 -64.71 142.27 58.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.183 -1.187 . . . . 0.0 109.921 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.89 -68.5 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.222 -0.924 . . . . 0.0 110.282 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -44.27 -43.56 7.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.3 -0.875 . . . . 0.0 110.245 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.592 ' CG2' HD11 ' A' ' 72' ' ' ILE . 7.0 m -58.11 -28.52 64.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.161 -0.962 . . . . 0.0 110.309 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 11' ' ' ALA . 17.6 mt -77.17 -29.8 54.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.272 -0.892 . . . . 0.0 110.164 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 15' ' ' LYS . 13.5 ttmt -60.01 -34.59 73.56 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.288 -0.882 . . . . 0.0 110.054 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 12.3 t -70.13 -37.08 75.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.355 -0.841 . . . . 0.0 110.664 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.443 HD11 HG12 ' A' ' 72' ' ' ILE . 20.7 mt -58.98 -48.17 82.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.137 -0.977 . . . . 0.0 110.45 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.3 ttp180 -47.33 -33.46 5.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.397 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.541 ' CD1' ' C ' ' A' ' 19' ' ' TYR . 4.2 t80 -64.59 -38.44 91.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.29 -0.882 . . . . 0.0 110.305 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -69.46 -33.16 72.51 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.18 -0.95 . . . . 0.0 110.213 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.536 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.48 -31.74 72.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.191 -0.943 . . . . 0.0 110.276 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.46 -16.54 60.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.227 -0.921 . . . . 0.0 110.148 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -75.02 -41.0 60.18 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.651 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.967 ' CG ' HD12 ' A' ' 27' ' ' LEU . 5.0 m-70 -95.08 75.97 3.49 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.305 -0.872 . . . . 0.0 109.559 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 p -58.18 -6.45 0.63 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.484 -0.76 . . . . 0.0 111.933 -179.233 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.82 31.98 1.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.584 -1.322 . . . . 0.0 111.1 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.967 HD12 ' CG ' ' A' ' 24' ' ' HIS . 2.1 mt -93.1 -35.46 13.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.437 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -107.94 169.68 8.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.17 -0.957 . . . . 0.0 110.318 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.517 ' OG1' ' N ' ' A' ' 54' ' ' ASP . 36.3 m -100.2 -34.36 10.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.286 -0.884 . . . . 0.0 111.131 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.51 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.75 117.72 2.7 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.977 -1.077 . . . . 0.0 110.72 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.595 ' O ' HG13 ' A' ' 31' ' ' VAL . 4.9 p -90.69 105.64 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.127 -0.983 . . . . 0.0 109.9 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.465 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 1.4 p -68.58 155.06 40.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.142 -0.974 . . . . 0.0 110.404 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.6 p -61.37 163.83 6.22 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 109.992 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -67.99 125.58 26.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.222 -0.924 . . . . 0.0 110.471 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.527 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 25.9 p-90 -146.11 173.34 12.28 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.079 -1.013 . . . . 0.0 109.738 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.527 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 11.0 p80 -162.61 -175.38 4.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.084 -1.01 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 68.3 m95 -79.31 155.03 28.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.278 -0.889 . . . . 0.0 110.105 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.491 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.243 0.544 . . . . 0.0 109.78 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.811 HG23 ' O ' ' A' ' 7' ' ' LEU . 43.6 mt -142.69 141.9 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.118 -0.989 . . . . 0.0 110.601 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 t -111.63 117.32 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.414 -0.804 . . . . 0.0 109.958 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.58 ' C ' HD12 ' A' ' 51' ' ' LEU . 50.3 m -93.69 146.58 23.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 110.008 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.58 HD12 ' C ' ' A' ' 50' ' ' THR . 5.4 mp -135.62 129.73 33.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.128 -0.983 . . . . 0.0 110.273 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.541 HG22 HG22 ' A' ' 4' ' ' ILE . 0.6 OUTLIER -97.95 136.4 38.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.548 -0.72 . . . . 0.0 110.114 179.72 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.522 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 89.9 m-85 -110.42 150.6 28.59 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.85 . . . . 0.0 109.865 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.517 ' N ' ' OG1' ' A' ' 29' ' ' THR . 1.8 t0 -84.52 -10.06 57.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.976 . . . . 0.0 110.458 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.51 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 0.4 OUTLIER -149.06 150.83 33.43 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.118 -0.989 . . . . 0.0 110.314 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.96 -56.21 9.86 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.523 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 12.3 p90 -53.95 -36.81 63.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.195 -0.941 . . . . 0.0 110.003 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.523 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 64.7 tt0 -58.32 -49.22 77.97 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.262 -0.899 . . . . 0.0 110.22 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -58.71 -36.27 73.99 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.264 -0.897 . . . . 0.0 110.112 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.661 ' HA ' HD21 ' A' ' 63' ' ' LEU . 18.8 m-20 -61.42 -42.24 98.43 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.28 -0.888 . . . . 0.0 110.528 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.49 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 62.1 mt-30 -65.92 -37.32 85.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.06 -1.025 . . . . 0.0 110.308 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.547 ' CD1' ' N ' ' A' ' 63' ' ' LEU . 10.5 t80 -55.41 -63.75 1.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.204 -0.935 . . . . 0.0 110.276 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 60' ' ' ASP . 3.2 pp -59.79 -17.1 33.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.251 -0.906 . . . . 0.0 110.585 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.443 ' HB3' ' O ' ' A' ' 60' ' ' ASP . 0.9 OUTLIER -83.87 -20.81 32.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.948 . . . . 0.0 110.434 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 41.5 mt-30 -95.53 -61.92 1.38 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.166 -0.959 . . . . 0.0 110.17 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.486 ' H ' HG22 ' A' ' 66' ' ' VAL . 15.7 m -79.63 70.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.156 -0.965 . . . . 0.0 109.876 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -44.85 117.98 1.49 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.551 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.496 HG12 ' HB ' ' A' ' 72' ' ' ILE . 0.9 OUTLIER -88.61 134.31 34.34 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 110.141 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.439 ' HG2' HD13 ' A' ' 72' ' ' ILE . 47.0 Cg_endo -55.25 176.52 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 123.875 1.46 . . . . 0.0 110.66 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.3 tptt -81.94 3.24 27.14 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.29 -33.19 24.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 109.795 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.592 HD11 ' CG2' ' A' ' 13' ' ' THR . 2.0 mp -93.92 123.21 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.412 -0.805 . . . . 0.0 109.903 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.6 m -94.61 138.17 32.81 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.46 HG22 ' N ' ' A' ' 75' ' ' SER . 7.7 p -90.86 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 0.0 111.171 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.564 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -143.69 157.57 44.3 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.736 -0.603 . . . . 0.0 110.058 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.9 p -133.13 133.12 42.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.187 -0.946 . . . . 0.0 110.172 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.7 -165.69 15.76 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' B' ' 78' ' ' PHE . 55.9 m-85 -147.88 153.63 39.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.185 -1.185 . . . . 0.0 110.356 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 93.5 mmm -139.26 152.78 47.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.219 -0.926 . . . . 0.0 110.2 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.5 t -134.96 100.57 4.62 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.229 -0.919 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 24.9 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.254 179.796 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' B' ' 2' ' ' THR . 69.6 mtm . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.236 0.541 . . . . 0.0 110.106 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' B' ' 1' ' ' MET . 54.7 m -43.79 104.25 0.37 Allowed Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.324 -0.86 . . . . 0.0 110.169 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.53 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.1 Cg_endo -55.38 157.73 14.04 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.14 1.6 . . . . 0.0 110.746 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.525 HG22 HG22 ' B' ' 52' ' ' THR . 2.6 pp -144.23 168.55 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.297 -0.877 . . . . 0.0 110.068 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.523 ' O ' HG13 ' B' ' 5' ' ' VAL . 9.4 p -146.45 129.76 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.154 -0.966 . . . . 0.0 110.552 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.572 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.1 OUTLIER -106.52 123.34 47.95 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.268 -0.895 . . . . 0.0 110.152 179.645 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.805 ' O ' HG23 ' B' ' 48' ' ' ILE . 12.1 mt -114.47 146.61 40.45 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.112 -0.992 . . . . 0.0 110.163 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.513 ' HB2' HG12 ' B' ' 48' ' ' ILE . 31.7 ttpt -141.48 165.42 27.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.08 -1.013 . . . . 0.0 110.723 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.425 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 154.44 -167.96 32.56 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 10' ' ' ASP . . . . . 0.438 ' O ' ' HB ' ' B' ' 13' ' ' THR . 8.8 m-20 -64.77 142.84 58.29 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.272 -1.134 . . . . 0.0 109.99 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.643 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.89 -68.72 0.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.231 -0.918 . . . . 0.0 110.529 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -44.43 -43.61 7.86 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 110.358 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.601 ' CG2' HD11 ' B' ' 72' ' ' ILE . 6.3 m -57.83 -28.74 64.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.164 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' B' ' 11' ' ' ALA . 19.9 mt -76.53 -30.31 57.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 15' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' B' ' 15' ' ' LYS . 12.5 ttmt -59.96 -35.11 74.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -0.855 . . . . 0.0 110.156 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.495 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 12.0 t -69.87 -36.75 75.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.202 -0.937 . . . . 0.0 110.425 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.44 HD11 HG12 ' B' ' 72' ' ' ILE . 19.0 mt -58.81 -48.62 80.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.092 -1.005 . . . . 0.0 110.541 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 19.0 ttp180 -47.5 -32.78 5.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.17 -0.956 . . . . 0.0 110.349 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.536 ' CD1' ' C ' ' B' ' 19' ' ' TYR . 4.6 t80 -64.76 -38.12 89.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.178 -0.951 . . . . 0.0 110.329 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -69.91 -33.4 72.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.201 -0.937 . . . . 0.0 110.264 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.54 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.34 -31.42 72.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.263 -0.898 . . . . 0.0 110.375 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.39 -16.83 61.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.204 -0.935 . . . . 0.0 110.254 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -74.89 -41.17 60.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.193 -0.942 . . . . 0.0 109.75 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.971 ' CG ' HD12 ' B' ' 27' ' ' LEU . 5.1 m-70 -94.89 76.11 3.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.263 -0.898 . . . . 0.0 109.368 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.03 -6.84 0.65 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.441 -0.787 . . . . 0.0 112.088 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.67 31.88 1.65 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.589 -1.319 . . . . 0.0 111.099 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.971 HD12 ' CG ' ' B' ' 24' ' ' HIS . 2.0 mt -93.02 -34.95 13.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.057 -1.027 . . . . 0.0 110.355 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -108.04 169.96 8.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.524 ' OG1' ' N ' ' B' ' 54' ' ' ASP . 40.1 m -100.32 -34.82 9.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.28 -0.888 . . . . 0.0 111.077 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.484 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.83 118.21 2.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.965 -1.085 . . . . 0.0 110.643 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.587 ' O ' HG13 ' B' ' 31' ' ' VAL . 5.4 p -90.82 105.17 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.116 -0.99 . . . . 0.0 110.055 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.488 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 1.7 p -68.22 154.76 41.08 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.146 -0.972 . . . . 0.0 110.292 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 12.9 p -61.36 164.64 5.36 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.173 -0.954 . . . . 0.0 110.153 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.13 124.93 24.79 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.292 -0.88 . . . . 0.0 110.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.54 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 25.1 p-90 -145.57 173.5 11.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.026 -1.046 . . . . 0.0 109.789 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.54 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 10.4 p80 -162.69 -175.06 4.24 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.614 -179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 67.1 m95 -79.8 155.66 27.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.333 -0.854 . . . . 0.0 110.063 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 O-C-N 121.13 -0.981 . . . . 0.0 110.23 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.507 ' HA ' ' HB3' ' B' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.112 0.482 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.805 HG23 ' O ' ' B' ' 7' ' ' LEU . 45.1 mt -142.66 142.34 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.169 -0.957 . . . . 0.0 110.645 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 t -112.01 117.06 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.443 -0.786 . . . . 0.0 109.716 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.577 ' C ' HD12 ' B' ' 51' ' ' LEU . 54.5 m -93.15 147.4 22.91 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.251 -0.906 . . . . 0.0 109.916 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.577 HD12 ' C ' ' B' ' 50' ' ' THR . 5.3 mp -136.28 129.77 31.98 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 110.317 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.525 HG22 HG22 ' B' ' 4' ' ' ILE . 0.6 OUTLIER -98.14 136.24 38.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 179.804 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.53 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 89.1 m-85 -110.56 150.74 28.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.294 -0.879 . . . . 0.0 109.839 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.524 ' N ' ' OG1' ' B' ' 29' ' ' THR . 1.4 t0 -84.7 -10.16 57.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.133 -0.979 . . . . 0.0 110.516 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 55' ' ' SER . . . . . 0.534 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 0.4 OUTLIER -148.49 151.51 35.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.153 -0.967 . . . . 0.0 110.243 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.31 -56.03 10.0 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.279 -0.888 . . . . 0.0 109.978 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 57' ' ' TRP . . . . . 0.534 ' CE2' ' HB3' ' B' ' 55' ' ' SER . 12.3 p90 -54.21 -37.15 64.25 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 0.0 110.228 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.53 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 63.8 tt0 -58.37 -48.32 80.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -0.929 . . . . 0.0 110.206 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -59.14 -36.59 75.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.149 -0.969 . . . . 0.0 110.154 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.637 ' HA ' HD21 ' B' ' 63' ' ' LEU . 19.3 m-20 -61.31 -41.91 97.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 110.437 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 61.6 mt-30 -65.91 -37.32 85.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 0.0 110.145 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.546 ' CD1' ' N ' ' B' ' 63' ' ' LEU . 10.5 t80 -55.64 -63.57 1.13 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.116 -0.99 . . . . 0.0 110.262 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.637 HD21 ' HA ' ' B' ' 60' ' ' ASP . 3.3 pp -59.93 -16.65 31.48 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.272 -0.892 . . . . 0.0 110.516 -179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' B' ' 60' ' ' ASP . 1.0 OUTLIER -84.5 -21.09 30.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.244 -0.91 . . . . 0.0 110.376 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 65' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 39.3 mt-30 -95.22 -62.85 1.23 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.982 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.477 ' H ' HG22 ' B' ' 66' ' ' VAL . 16.3 m -78.57 70.88 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.049 -1.032 . . . . 0.0 109.816 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -45.75 118.37 1.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.289 -0.882 . . . . 0.0 110.472 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.478 HG12 ' HB ' ' B' ' 72' ' ' ILE . 0.9 OUTLIER -88.71 134.91 32.94 Favored Pre-proline 0 N--CA 1.486 1.35 0 O-C-N 121.232 -0.917 . . . . 0.0 110.331 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.464 ' HG2' HD13 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -55.88 176.8 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.048 1.552 . . . . 0.0 110.663 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -82.61 3.23 29.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.351 -0.843 . . . . 0.0 110.356 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -32.79 24.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.131 -0.981 . . . . 0.0 109.696 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.601 HD11 ' CG2' ' B' ' 13' ' ' THR . 2.0 mp -94.48 123.61 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.552 -0.717 . . . . 0.0 109.985 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.5 m -95.06 138.42 32.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.155 -0.965 . . . . 0.0 109.982 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.455 HG22 ' N ' ' B' ' 75' ' ' SER . 7.4 p -90.78 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.151 -0.968 . . . . 0.0 110.995 -178.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 75' ' ' SER . . . . . 0.572 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.62 157.65 44.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.763 -0.585 . . . . 0.0 110.173 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.2 p -133.49 133.57 42.39 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.0 110.281 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.87 -165.15 14.89 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 78' ' ' PHE . 55.7 m-85 -148.15 153.12 38.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.176 -1.19 . . . . 0.0 110.207 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 95.1 mmm -138.59 152.68 48.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t -135.09 100.58 4.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 110.338 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.173 179.945 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.7 mtp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.183 0.516 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.29 132.84 43.93 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.002 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.49 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 43.1 Cg_endo -91.2 166.19 3.65 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.78 1.411 . . . . 0.0 110.668 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.438 HG21 ' HG3' ' A' ' 79' ' ' MET . 1.4 pt -144.05 179.62 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.408 -0.808 . . . . 0.0 110.154 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.534 HG13 ' CG2' ' A' ' 74' ' ' VAL . 1.0 OUTLIER -146.33 129.88 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.245 -0.909 . . . . 0.0 110.193 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.563 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.38 121.48 43.99 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.308 -0.87 . . . . 0.0 110.088 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 1.058 ' O ' HG23 ' A' ' 48' ' ' ILE . 4.2 tp -119.74 139.92 51.53 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.192 -0.943 . . . . 0.0 110.148 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.514 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.6 ttpp -142.39 167.13 22.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 0.0 110.573 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.514 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 154.74 -166.49 32.39 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.489 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 65.4 m-20 -64.65 136.73 57.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -1.233 . . . . 0.0 109.968 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.409 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.78 -46.57 59.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 111.169 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -63.51 -46.8 84.38 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.118 -0.989 . . . . 0.0 111.196 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.489 ' OG1' ' HB2' ' A' ' 10' ' ' ASP . 6.4 m -57.72 -31.19 66.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.901 -1.125 . . . . 0.0 110.383 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.483 HD12 ' O ' ' A' ' 10' ' ' ASP . 6.7 mt -75.06 -25.44 58.63 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -59.46 -40.63 87.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.545 -0.722 . . . . 0.0 110.294 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 22.4 t -70.12 -36.89 75.14 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.222 -0.924 . . . . 0.0 110.527 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 mt -58.85 -54.79 43.09 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.085 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.493 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 26.9 ttt180 -47.28 -26.29 1.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.54 -0.725 . . . . 0.0 110.762 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.489 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 10.9 t80 -64.92 -50.9 64.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 0.0 110.747 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.48 -13.54 62.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.474 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.493 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 2.4 m-30 -66.33 -35.4 80.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.203 -0.936 . . . . 0.0 110.076 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -63.52 -29.83 71.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.32 -0.862 . . . . 0.0 110.261 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -74.91 -41.09 60.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.21 -0.931 . . . . 0.0 109.762 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.705 ' HB3' HD22 ' A' ' 27' ' ' LEU . 68.2 m-70 -95.14 37.27 1.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.32 -0.863 . . . . 0.0 109.94 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.605 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 8.7 p -57.22 -14.35 4.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.311 -0.868 . . . . 0.0 110.428 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 p -96.72 6.67 48.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.103 -0.998 . . . . 0.0 110.182 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' A' ' 24' ' ' HIS . 6.6 mp -92.39 -35.04 13.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 110.376 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 39.3 p90 -111.05 165.77 11.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.189 -0.944 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.06 -30.47 12.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.233 -0.917 . . . . 0.0 110.737 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.568 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.66 114.48 2.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.226 -0.921 . . . . 0.0 110.557 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.766 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.7 p -89.98 99.69 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.119 -0.988 . . . . 0.0 110.135 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.481 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -50.74 147.9 4.44 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.217 -0.927 . . . . 0.0 110.179 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t -60.82 164.47 4.75 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.085 -1.01 . . . . 0.0 109.829 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.7 121.21 15.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.173 -0.954 . . . . 0.0 110.255 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.532 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 55.7 p-90 -145.03 -177.56 5.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 109.605 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.501 ' CD2' ' C ' ' A' ' 35' ' ' TRP . 0.8 OUTLIER -162.68 170.73 17.97 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.027 -1.045 . . . . 0.0 110.422 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.418 ' CZ2' ' HH2' ' A' ' 35' ' ' TRP . 26.3 m95 -79.37 105.23 10.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.337 -0.852 . . . . 0.0 110.033 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.588 ' O ' HG13 ' B' ' 31' ' ' VAL . 9.0 t . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.272 -0.893 . . . . 0.0 110.315 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.386 0.612 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 1.058 HG23 ' O ' ' A' ' 7' ' ' LEU . 19.1 mt -141.96 148.81 20.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.336 -0.852 . . . . 0.0 109.678 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.2 t -126.69 113.12 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.104 -0.998 . . . . 0.0 110.654 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.414 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 94.6 m -93.86 156.88 16.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 109.809 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 50' ' ' THR . 1.6 mp -137.36 139.86 41.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.565 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.568 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 0.0 OUTLIER -96.54 125.08 40.77 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.653 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.49 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 28.3 m-85 -107.79 148.71 29.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.445 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.51 -16.78 28.24 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 85.0 p -147.61 148.15 30.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.148 -0.97 . . . . 0.0 110.178 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 16.0 mt-10 -70.16 -36.97 75.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.209 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 43.2 t-105 -53.78 -48.0 70.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.296 -0.877 . . . . 0.0 109.988 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 55.2 tt0 -57.07 -36.05 70.09 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.312 -0.867 . . . . 0.0 110.53 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.444 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 1.1 ttp180 -59.62 -44.93 93.29 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.208 -0.933 . . . . 0.0 110.948 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -61.3 -40.58 94.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.111 -0.993 . . . . 0.0 111.391 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.443 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 37.3 mt-30 -65.42 -43.33 90.85 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.886 -1.134 . . . . 0.0 110.743 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.801 ' O ' HG22 ' A' ' 66' ' ' VAL . 15.9 t80 -55.96 -51.72 66.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.23 -0.919 . . . . 0.0 110.789 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 43.1 mt -59.61 -14.74 14.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.199 -0.938 . . . . 0.0 110.605 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.8 t -96.44 -21.91 17.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.897 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 4.8 mt-30 -95.85 -34.19 11.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.071 -1.018 . . . . 0.0 110.438 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.801 HG22 ' O ' ' A' ' 62' ' ' PHE . 19.5 m -87.03 109.12 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.101 -0.999 . . . . 0.0 110.624 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.3 137.33 36.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.561 HD11 HG21 ' A' ' 72' ' ' ILE . 18.2 tt -150.37 131.57 7.41 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.011 -1.055 . . . . 0.0 110.739 -179.202 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.626 ' HG2' HG22 ' A' ' 71' ' ' THR . 43.6 Cg_endo -47.28 -178.39 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 124.246 1.656 . . . . 0.0 111.063 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.54 6.06 45.17 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.235 -0.915 . . . . 0.0 110.377 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.862 HG23 HG12 ' A' ' 72' ' ' ILE . 9.8 t -84.21 -30.38 25.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.063 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.862 HG12 HG23 ' A' ' 71' ' ' THR . 17.3 mm -94.86 103.23 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.4 m -95.35 157.78 15.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.243 -0.911 . . . . 0.0 109.997 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.615 ' HB ' HD12 ' A' ' 7' ' ' LEU . 9.8 p -145.85 157.88 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.147 -0.971 . . . . 0.0 110.592 -179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.59 -179.13 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.452 -0.78 . . . . 0.0 110.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 p -107.4 170.46 7.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.109 -0.994 . . . . 0.0 110.79 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.427 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -164.4 -174.07 33.76 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' B' ' 78' ' ' PHE . 38.6 m-85 -148.1 142.08 25.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.223 -1.163 . . . . 0.0 110.69 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.438 ' HG3' HG21 ' A' ' 4' ' ' ILE . 90.3 mmm -122.94 156.91 33.75 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 110.042 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.415 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -135.62 102.74 5.2 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.349 -0.844 . . . . 0.0 110.146 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.415 HG23 ' C ' ' A' ' 80' ' ' SER . 14.4 pt . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.289 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.185 0.517 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.54 132.99 42.96 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 109.964 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.497 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 44.2 Cg_endo -91.8 165.9 3.29 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.923 1.486 . . . . 0.0 110.678 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.453 HG21 ' HG3' ' B' ' 79' ' ' MET . 1.4 pt -144.18 -179.92 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.354 -0.841 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.537 HG13 ' CG2' ' B' ' 74' ' ' VAL . 1.0 OUTLIER -146.59 130.94 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.119 -0.988 . . . . 0.0 110.213 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.574 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.0 OUTLIER -106.06 121.69 44.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.124 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 1.043 ' O ' HG23 ' B' ' 48' ' ' ILE . 4.2 tp -119.79 139.94 51.54 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.216 -0.928 . . . . 0.0 110.1 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.508 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 9.9 ttpp -142.55 167.36 22.27 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.11 -0.994 . . . . 0.0 110.534 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.508 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 154.74 -166.34 32.34 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 10' ' ' ASP . . . . . 0.499 ' HB2' ' OG1' ' B' ' 13' ' ' THR . 67.2 m-20 -64.99 136.42 56.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.129 -1.218 . . . . 0.0 109.752 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.431 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.57 -45.53 57.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 111.297 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -64.38 -46.3 83.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.121 -0.987 . . . . 0.0 111.117 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.499 ' OG1' ' HB2' ' B' ' 10' ' ' ASP . 6.5 m -57.87 -31.57 66.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.026 -1.046 . . . . 0.0 110.345 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.461 HD12 ' O ' ' B' ' 10' ' ' ASP . 6.2 mt -74.93 -25.13 58.68 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.211 -0.931 . . . . 0.0 109.548 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.58 -40.31 86.98 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.438 -0.789 . . . . 0.0 110.069 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.491 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.0 t -70.21 -37.25 75.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.308 -0.87 . . . . 0.0 110.473 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 17.1 mt -58.81 -54.62 45.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.19 -0.944 . . . . 0.0 110.17 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.501 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 27.6 ttt180 -47.19 -26.19 1.1 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.494 -0.754 . . . . 0.0 110.77 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.491 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 11.1 t80 -65.03 -50.79 64.86 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.038 -1.039 . . . . 0.0 110.79 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.66 -13.39 62.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.168 -0.958 . . . . 0.0 110.539 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.501 ' HB2' ' O ' ' B' ' 18' ' ' ARG . 2.4 m-30 -66.48 -35.62 80.73 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.15 -0.969 . . . . 0.0 110.262 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -63.33 -29.87 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.188 -0.945 . . . . 0.0 110.37 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -74.85 -41.26 60.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.108 -0.995 . . . . 0.0 109.831 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.721 ' HB3' HD22 ' B' ' 27' ' ' LEU . 66.7 m-70 -95.09 37.05 1.17 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.34 -0.85 . . . . 0.0 109.861 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.611 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 7.7 p -57.07 -14.44 3.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.376 -0.827 . . . . 0.0 110.457 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 27.5 p -96.35 6.77 48.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.168 -0.957 . . . . 0.0 110.103 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.721 HD22 ' HB3' ' B' ' 24' ' ' HIS . 6.5 mp -92.54 -35.5 13.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.315 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.611 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 37.5 p90 -110.54 166.21 11.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.147 -0.971 . . . . 0.0 110.197 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.7 -30.24 12.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.296 -0.878 . . . . 0.0 110.766 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.586 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.56 114.15 2.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.13 -0.981 . . . . 0.0 110.49 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.762 ' O ' HG13 ' B' ' 31' ' ' VAL . 12.1 p -90.02 99.36 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.097 -1.002 . . . . 0.0 109.725 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.532 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -50.87 148.28 4.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.117 -0.99 . . . . 0.0 110.102 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 33' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' A' ' 35' ' ' TRP . 3.9 t -60.98 164.62 4.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.894 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.6 m -67.69 121.71 16.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.237 -0.914 . . . . 0.0 110.319 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.5 ' C ' ' CD2' ' B' ' 36' ' ' HIS . 56.6 p-90 -145.34 -177.13 5.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.149 -0.969 . . . . 0.0 109.741 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.5 ' CD2' ' C ' ' B' ' 35' ' ' TRP . 0.7 OUTLIER -162.67 170.45 18.43 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.033 -1.042 . . . . 0.0 110.41 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.428 ' CZ3' ' OG1' ' A' ' 52' ' ' THR . 26.4 m95 -79.26 104.93 10.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 38' ' ' THR . . . . . 0.678 ' O ' HG13 ' A' ' 31' ' ' VAL . 8.8 t . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.297 -0.877 . . . . 0.0 110.185 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.3 0.571 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 1.043 HG23 ' O ' ' B' ' 7' ' ' LEU . 19.7 mt -141.64 149.16 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 109.704 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 93.1 t -126.91 113.28 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.112 -0.992 . . . . 0.0 110.626 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.41 ' O ' ' HG ' ' B' ' 51' ' ' LEU . 97.7 m -94.26 156.86 16.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 109.899 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' B' ' 50' ' ' THR . 1.7 mp -137.22 139.84 41.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.045 -1.034 . . . . 0.0 110.623 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.586 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 0.0 OUTLIER -96.67 125.18 40.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.728 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.497 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 28.9 m-85 -107.99 149.08 28.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 0.0 110.528 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.84 -16.59 28.01 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.407 -0.808 . . . . 0.0 110.17 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 85.1 p -147.83 146.7 29.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.453 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 15.6 mt-10 -68.71 -37.64 79.65 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.152 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 44.3 t-105 -53.7 -48.32 69.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.318 -0.864 . . . . 0.0 110.112 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.491 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.5 tt0 -56.8 -35.72 69.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.408 -0.807 . . . . 0.0 110.453 -179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.462 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 1.1 ttp180 -59.83 -45.44 92.39 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.042 -1.036 . . . . 0.0 110.979 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -60.95 -40.23 92.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.163 -0.96 . . . . 0.0 111.235 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 37.8 mt-30 -65.62 -43.44 89.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.051 -1.031 . . . . 0.0 110.73 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.793 ' O ' HG22 ' B' ' 66' ' ' VAL . 17.1 t80 -55.88 -51.66 66.79 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.286 -0.884 . . . . 0.0 110.672 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.78 -15.51 20.98 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.134 -0.979 . . . . 0.0 110.765 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 10.6 t -95.49 -21.99 17.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.117 -0.989 . . . . 0.0 110.974 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 4.6 mt-30 -95.91 -33.06 12.33 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.079 -1.013 . . . . 0.0 110.545 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.793 HG22 ' O ' ' B' ' 62' ' ' PHE . 20.1 m -88.3 109.43 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.208 -0.932 . . . . 0.0 110.616 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.97 137.29 36.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.945 . . . . 0.0 109.507 179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.556 HD11 HG21 ' B' ' 72' ' ' ILE . 18.4 tt -150.3 131.68 7.5 Favored Pre-proline 0 C--N 1.305 -1.369 0 O-C-N 120.993 -1.067 . . . . 0.0 110.518 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.615 ' HG2' HG22 ' B' ' 71' ' ' THR . 42.2 Cg_endo -47.93 -179.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.711 0 O-C-N 124.148 1.604 . . . . 0.0 110.942 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -89.48 5.75 43.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.37 -0.831 . . . . 0.0 110.481 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 71' ' ' THR . . . . . 0.874 HG23 HG12 ' B' ' 72' ' ' ILE . 9.4 t -84.17 -30.58 25.71 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.158 -0.964 . . . . 0.0 110.227 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.874 HG12 HG23 ' B' ' 71' ' ' THR . 16.8 mm -94.6 103.52 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -0.926 . . . . 0.0 110.254 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 63.2 m -95.41 157.39 15.92 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.237 -0.914 . . . . 0.0 110.204 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.616 ' HB ' HD12 ' B' ' 7' ' ' LEU . 9.8 p -145.64 157.49 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.059 -1.026 . . . . 0.0 110.743 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.3 -178.99 5.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.496 -0.753 . . . . 0.0 109.875 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.5 p -107.15 171.91 7.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.102 -0.999 . . . . 0.0 110.773 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.447 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -164.98 -175.1 35.4 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' A' ' 78' ' ' PHE . 36.8 m-85 -147.8 140.57 24.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -1.133 . . . . 0.0 110.462 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.453 ' HG3' HG21 ' B' ' 4' ' ' ILE . 89.6 mmm -121.99 157.53 31.12 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 110.033 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.407 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.3 OUTLIER -135.84 103.51 5.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.239 -0.913 . . . . 0.0 110.178 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.407 HG23 ' C ' ' B' ' 80' ' ' SER . 13.8 pt . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.18 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.252 0.549 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 m -72.33 123.62 89.74 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.286 -0.884 . . . . 0.0 110.256 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.562 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.7 Cg_endo -76.92 153.06 32.6 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 O-C-N 123.947 1.498 . . . . 0.0 110.296 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.653 HD11 ' HA3' ' A' ' 77' ' ' GLY . 0.8 OUTLIER -144.2 176.4 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.482 HG23 ' HB2' ' A' ' 51' ' ' LEU . 2.4 m -146.33 129.05 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.313 -0.867 . . . . 0.0 110.214 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.494 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 1.1 m170 -104.98 116.51 32.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.936 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.582 HD12 ' O ' ' A' ' 49' ' ' VAL . 1.0 OUTLIER -109.75 142.51 40.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.225 -0.922 . . . . 0.0 110.142 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.914 ' HD3' HD11 ' A' ' 48' ' ' ILE . 14.9 ttpt -141.5 166.48 24.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.261 -0.899 . . . . 0.0 110.492 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.25 -160.05 29.23 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.04 136.52 56.86 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -1.183 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.99 -29.59 8.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.301 -0.874 . . . . 0.0 110.52 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -78.01 -46.3 21.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.106 -0.996 . . . . 0.0 110.173 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.7 m -58.1 -14.08 6.09 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.389 -0.82 . . . . 0.0 110.419 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.561 ' HA ' HD12 ' A' ' 17' ' ' LEU . 16.0 mt -87.62 -38.39 15.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 110.423 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.03 -37.39 79.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.221 -0.924 . . . . 0.0 110.227 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 8.0 t -70.08 -37.29 75.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.317 -0.864 . . . . 0.0 110.558 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.599 HD11 HG13 ' A' ' 72' ' ' ILE . 19.1 mt -58.75 -48.84 79.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.079 -1.013 . . . . 0.0 110.223 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.587 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 19.5 ttm180 -47.69 -37.3 12.74 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.253 -0.905 . . . . 0.0 110.253 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 18.1 t80 -64.76 -31.25 72.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 0.0 110.627 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.451 ' NH1' ' HE3' ' A' ' 67' ' ' LYS . 6.2 mmt180 -70.42 -30.54 67.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.147 -0.971 . . . . 0.0 110.205 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.587 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.1 m-30 -66.63 -17.26 64.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.894 . . . . 0.0 110.327 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.8 mmtt -63.63 -33.0 74.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.305 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.509 ' O ' ' ND1' ' A' ' 24' ' ' HIS . 4.1 mmtp -75.03 -10.87 59.88 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.205 -0.934 . . . . 0.0 110.225 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.875 ' CB ' HD22 ' A' ' 27' ' ' LEU . 8.0 m-70 -144.7 46.32 1.37 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.215 -0.928 . . . . 0.0 109.928 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.534 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 11.3 t -57.43 -14.87 5.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.464 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -96.48 17.01 17.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.139 -0.976 . . . . 0.0 110.325 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.875 HD22 ' CB ' ' A' ' 24' ' ' HIS . 5.0 mp -92.41 -35.11 13.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.248 -0.908 . . . . 0.0 110.017 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.534 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 16.8 p90 -108.03 172.75 6.66 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.208 -0.933 . . . . 0.0 109.994 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 96.4 m -99.82 -32.05 11.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.198 -0.938 . . . . 0.0 111.372 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.75 119.89 3.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.859 -1.151 . . . . 0.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.644 ' O ' HG13 ' A' ' 31' ' ' VAL . 9.4 p -89.1 114.9 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 109.655 179.213 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.614 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -83.79 152.78 24.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.149 -0.969 . . . . 0.0 110.671 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.4 p -61.36 164.79 5.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.322 -0.861 . . . . 0.0 110.425 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 m -68.12 126.17 28.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.355 -0.841 . . . . 0.0 110.239 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.592 ' CZ3' ' CB ' ' B' ' 32' ' ' SER . 1.6 p-90 -145.46 164.4 31.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.042 -1.036 . . . . 0.0 109.438 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.45 ' HE1' HG21 ' A' ' 38' ' ' THR . 2.1 p80 -162.45 -178.72 6.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.967 -1.083 . . . . 0.0 110.973 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.481 ' O ' ' HB ' ' A' ' 38' ' ' THR . 33.7 m95 -79.55 126.49 30.94 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.525 -0.734 . . . . 0.0 110.664 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.481 ' HB ' ' O ' ' A' ' 37' ' ' TRP . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.329 -0.857 . . . . 0.0 110.063 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.457 ' O ' HD11 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.194 0.521 . . . . 0.0 110.156 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.914 HD11 ' HD3' ' A' ' 8' ' ' LYS . 20.0 mt -142.49 147.31 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 0.0 110.248 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.582 ' O ' HD12 ' A' ' 7' ' ' LEU . 21.3 t -125.36 119.93 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.294 -0.879 . . . . 0.0 110.234 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.494 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 16.0 m -94.22 151.86 19.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.256 -0.902 . . . . 0.0 110.132 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.482 ' HB2' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -137.08 131.73 33.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 110.07 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.473 ' HA ' HG22 ' A' ' 4' ' ' ILE . 40.2 p -97.77 136.37 38.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -0.833 . . . . 0.0 110.239 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.562 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 37.5 m-85 -116.16 153.99 30.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.0 110.125 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -89.92 -13.88 35.37 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.25 -0.907 . . . . 0.0 110.768 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.591 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 1.7 m -142.28 151.13 41.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.044 -1.035 . . . . 0.0 110.221 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -70.97 -53.9 13.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.668 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 6.9 p90 -54.03 -35.16 61.64 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.098 -1.001 . . . . 0.0 110.063 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.668 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 33.3 tt0 -56.89 -37.76 71.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 110.024 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -59.59 -40.21 86.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.658 ' HA ' HD12 ' A' ' 63' ' ' LEU . 96.5 m-20 -61.08 -40.36 93.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.329 -0.857 . . . . 0.0 110.458 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.489 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 40.5 mt-30 -65.66 -40.68 92.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.224 -0.923 . . . . 0.0 110.36 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.681 ' CE2' HG21 ' A' ' 66' ' ' VAL . 85.9 t80 -55.7 -39.81 71.54 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.108 -0.995 . . . . 0.0 109.531 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 60' ' ' ASP . 62.2 mt -58.89 -27.64 65.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.389 -0.819 . . . . 0.0 109.713 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 8.5 p -96.37 -6.21 38.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 109.794 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.517 ' CG ' HD21 ' A' ' 27' ' ' LEU . 20.0 mm-40 -95.23 -28.36 15.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.394 -0.817 . . . . 0.0 109.741 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.722 ' O ' HG23 ' A' ' 66' ' ' VAL . 33.3 m -131.26 85.47 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.324 -0.86 . . . . 0.0 109.863 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.451 ' HE3' ' NH1' ' A' ' 20' ' ' ARG . 7.4 pttp -41.85 135.82 2.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.237 -0.914 . . . . 0.0 110.423 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.487 HD12 ' O ' ' A' ' 66' ' ' VAL . 1.4 mp -88.41 148.69 42.94 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.369 -0.832 . . . . 0.0 110.126 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.527 ' CG ' ' CG1' ' A' ' 72' ' ' ILE . 46.3 Cg_endo -70.81 -160.06 0.07 OUTLIER 'Trans proline' 0 C--N 1.302 -1.872 0 O-C-N 124.163 1.612 . . . . 0.0 110.579 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.551 ' O ' HG23 ' A' ' 71' ' ' THR . 0.3 OUTLIER -104.9 24.61 11.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.551 HG23 ' O ' ' A' ' 70' ' ' LYS . 1.9 p -154.42 3.15 0.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 111.441 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.75 HD13 ' O ' ' A' ' 8' ' ' LYS . 9.6 mm -95.12 121.16 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.807 -1.183 . . . . 0.0 109.901 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.469 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 1.7 m -94.86 129.81 41.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 110.29 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.562 ' O ' HG13 ' A' ' 74' ' ' VAL . 2.9 p -112.02 100.37 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.476 -0.765 . . . . 0.0 109.822 178.513 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.02 175.99 5.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.746 -1.221 . . . . 0.0 110.536 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.9 p -109.06 153.26 23.9 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.025 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.653 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -162.16 178.36 38.0 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -147.84 139.14 23.58 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.269 -1.136 . . . . 0.0 110.263 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.417 ' SD ' ' CE1' ' B' ' 6' ' ' HIS . 2.1 mtm -126.01 138.21 53.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.108 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.26 101.82 6.91 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.23 -0.918 . . . . 0.0 110.336 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.19 179.879 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.244 0.545 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 3.0 m -71.96 123.76 89.91 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 110.279 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -76.97 153.21 32.47 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 123.997 1.525 . . . . 0.0 110.262 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.659 HD11 ' HA3' ' B' ' 77' ' ' GLY . 0.7 OUTLIER -144.28 176.07 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.324 -0.86 . . . . 0.0 110.245 179.822 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.467 HG23 ' HB2' ' B' ' 51' ' ' LEU . 2.5 m -146.05 128.86 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.33 -0.856 . . . . 0.0 110.179 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.469 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.1 m170 -104.57 118.57 36.92 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.255 -0.903 . . . . 0.0 109.624 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.573 HD12 ' O ' ' B' ' 49' ' ' VAL . 1.0 OUTLIER -111.69 142.37 44.11 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.426 -0.796 . . . . 0.0 110.139 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.91 ' HD3' HD11 ' B' ' 48' ' ' ILE . 15.0 ttpt -141.64 166.05 25.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.85 -160.14 29.48 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.98 136.17 56.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.279 -1.13 . . . . 0.0 110.158 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.83 -30.19 9.37 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.271 -0.893 . . . . 0.0 110.305 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -76.82 -46.76 23.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.254 -0.904 . . . . 0.0 110.223 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -57.96 -15.24 8.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.32 -0.862 . . . . 0.0 110.533 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' B' ' 17' ' ' LEU . 16.6 mt -86.4 -38.07 17.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 110.561 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.1 -37.53 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.199 -0.938 . . . . 0.0 110.325 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.471 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 8.4 t -69.93 -37.22 75.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.919 . . . . 0.0 110.344 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' B' ' 14' ' ' LEU . 19.8 mt -58.69 -49.03 79.07 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.231 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.584 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 19.1 ttm180 -47.93 -36.62 12.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.409 -0.807 . . . . 0.0 110.151 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.471 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 21.9 t80 -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.427 -0.796 . . . . 0.0 110.503 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 20' ' ' ARG . . . . . 0.457 ' NH1' ' HE3' ' B' ' 67' ' ' LYS . 6.3 mmt180 -69.83 -31.05 68.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.228 -0.92 . . . . 0.0 110.33 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.584 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.2 m-30 -66.4 -17.21 64.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.199 -0.938 . . . . 0.0 110.317 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -63.46 -32.83 74.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.26 -0.9 . . . . 0.0 110.191 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' LYS . . . . . 0.507 ' O ' ' ND1' ' B' ' 24' ' ' HIS . 4.0 mmtp -75.26 -10.67 59.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.208 -0.933 . . . . 0.0 110.214 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.877 ' CB ' HD22 ' B' ' 27' ' ' LEU . 8.6 m-70 -145.06 46.46 1.33 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.229 -0.919 . . . . 0.0 109.998 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.567 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 13.9 t -57.29 -14.54 4.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.258 -0.902 . . . . 0.0 110.565 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -96.59 16.26 19.35 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.251 -0.905 . . . . 0.0 110.294 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.877 HD22 ' CB ' ' B' ' 24' ' ' HIS . 5.2 mp -92.12 -34.08 14.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 110.025 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.567 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 17.1 p90 -108.37 172.54 6.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.9 . . . . 0.0 110.048 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -99.97 -32.11 11.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.157 -0.965 . . . . 0.0 111.283 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.86 119.88 2.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.899 -1.126 . . . . 0.0 111.013 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.632 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.3 p -89.46 115.2 28.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.277 -0.889 . . . . 0.0 109.567 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.592 ' CB ' ' CZ3' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -83.92 153.34 24.01 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.204 -0.935 . . . . 0.0 110.74 -179.417 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 60.3 p -61.56 164.44 5.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.328 -0.858 . . . . 0.0 110.314 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -68.05 126.45 29.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.287 -0.883 . . . . 0.0 110.25 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.614 ' CZ3' ' CB ' ' A' ' 32' ' ' SER . 1.7 p-90 -145.71 164.93 30.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.014 -1.054 . . . . 0.0 109.567 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.438 ' HE1' HG21 ' B' ' 38' ' ' THR . 2.3 p80 -162.46 -177.91 5.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.951 -1.093 . . . . 0.0 110.972 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.496 ' O ' ' HB ' ' B' ' 38' ' ' THR . 34.1 m95 -79.87 127.0 31.72 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.415 -0.803 . . . . 0.0 110.507 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' THR . . . . . 0.567 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.271 -0.893 . . . . 0.0 110.167 179.492 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.47 ' O ' HD11 ' B' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.159 0.504 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.91 HD11 ' HD3' ' B' ' 8' ' ' LYS . 20.1 mt -142.48 146.84 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.274 -0.891 . . . . 0.0 110.318 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 49' ' ' VAL . . . . . 0.573 ' O ' HD12 ' B' ' 7' ' ' LEU . 21.4 t -124.65 120.31 58.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.469 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 16.7 m -94.35 151.22 19.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.073 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.477 HD23 ' HB2' ' B' ' 28' ' ' TYR . 0.2 OUTLIER -136.83 131.76 33.7 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.927 . . . . 0.0 110.165 179.709 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.445 ' HA ' HG22 ' B' ' 4' ' ' ILE . 40.8 p -98.01 136.2 38.62 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.368 -0.833 . . . . 0.0 110.364 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.561 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 37.6 m-85 -116.18 154.13 30.6 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 110.147 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -90.07 -14.38 33.92 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.175 -0.953 . . . . 0.0 110.736 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' SER . . . . . 0.607 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 1.7 m -141.39 151.73 43.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.105 -0.997 . . . . 0.0 110.21 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -71.92 -53.55 12.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.23 -0.919 . . . . 0.0 110.37 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 57' ' ' TRP . . . . . 0.67 ' CD1' ' N ' ' B' ' 58' ' ' GLN . 6.3 p90 -53.92 -34.84 60.74 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.109 -0.995 . . . . 0.0 109.945 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.67 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 32.5 tt0 -57.0 -38.31 72.91 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.08 -1.012 . . . . 0.0 110.033 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -59.48 -39.71 84.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.226 -0.921 . . . . 0.0 109.927 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.637 ' HA ' HD12 ' B' ' 63' ' ' LEU . 96.6 m-20 -61.31 -39.97 92.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.317 -0.865 . . . . 0.0 110.216 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 65.3 mt-30 -65.85 -41.31 91.87 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.475 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.658 ' CE2' HG21 ' B' ' 66' ' ' VAL . 85.8 t80 -55.62 -39.5 70.89 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.196 -0.94 . . . . 0.0 109.53 179.657 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.637 HD12 ' HA ' ' B' ' 60' ' ' ASP . 67.1 mt -58.89 -27.25 65.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.472 -0.767 . . . . 0.0 109.827 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.433 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 6.5 p -96.95 -6.11 36.32 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.368 -0.832 . . . . 0.0 109.92 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 65' ' ' GLN . . . . . 0.514 ' CG ' HD21 ' B' ' 27' ' ' LEU . 19.5 mm-40 -95.13 -29.01 14.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.33 -0.856 . . . . 0.0 109.659 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.729 HG23 ' O ' ' B' ' 66' ' ' VAL . 33.1 m -130.55 86.69 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.443 -0.786 . . . . 0.0 109.79 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.457 ' HE3' ' NH1' ' B' ' 20' ' ' ARG . 6.9 pttp -43.15 136.18 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.242 -0.911 . . . . 0.0 110.278 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.472 HD12 ' O ' ' B' ' 66' ' ' VAL . 1.4 mp -88.49 148.61 42.58 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.24 -0.912 . . . . 0.0 109.992 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.539 ' HG2' ' CG1' ' B' ' 72' ' ' ILE . 45.0 Cg_endo -71.0 -160.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.1 1.579 . . . . 0.0 110.553 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.554 ' O ' HG23 ' B' ' 71' ' ' THR . 0.4 OUTLIER -104.43 24.77 11.1 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.136 -0.978 . . . . 0.0 110.44 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 71' ' ' THR . . . . . 0.554 HG23 ' O ' ' B' ' 70' ' ' LYS . 2.1 p -154.49 3.67 0.24 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.15 -0.969 . . . . 0.0 111.397 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.765 HD13 ' O ' ' B' ' 8' ' ' LYS . 9.8 mm -95.48 121.49 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.774 -1.204 . . . . 0.0 109.917 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 73' ' ' THR . . . . . 0.46 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 1.6 m -95.28 129.61 42.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.202 -0.936 . . . . 0.0 110.394 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.54 HG13 ' O ' ' B' ' 74' ' ' VAL . 2.6 p -111.65 99.86 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.497 -0.752 . . . . 0.0 109.803 178.57 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.92 174.86 5.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.656 -1.278 . . . . 0.0 110.424 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.1 p -107.8 152.93 23.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.402 -0.811 . . . . 0.0 110.149 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.659 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -161.45 178.49 37.34 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -147.97 139.39 23.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.25 -1.147 . . . . 0.0 110.256 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.0 mtm -126.36 139.14 53.52 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.13 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.89 101.71 6.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.411 ' OXT' HG22 ' B' ' 81' ' ' ILE . 4.1 mt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.07 -0.966 . . . . 0.0 110.207 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.458 ' HB3' ' HB3' ' A' ' 78' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.297 0.57 . . . . 0.0 110.138 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.456 ' O ' HG23 ' A' ' 4' ' ' ILE . 66.8 p -96.23 106.68 30.4 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.384 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.415 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 48.5 Cg_endo -52.82 155.7 10.42 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 O-C-N 124.034 1.544 . . . . 0.0 110.315 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.456 HG23 ' O ' ' A' ' 2' ' ' THR . 7.1 pt -143.47 178.69 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.663 HG13 ' CG1' ' A' ' 74' ' ' VAL . 40.3 t -145.53 136.04 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.281 -0.887 . . . . 0.0 110.381 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.558 ' O ' HG22 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.54 121.4 43.88 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.329 -0.857 . . . . 0.0 109.795 179.647 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.637 HD12 HG12 ' A' ' 5' ' ' VAL . 0.4 OUTLIER -115.51 123.81 49.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.546 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.622 ' HD2' HD11 ' A' ' 48' ' ' ILE . 18.8 tttt -141.48 166.22 25.35 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.236 -0.915 . . . . 0.0 110.209 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.531 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 141.88 -146.07 16.87 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.92 121.38 14.51 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.322 -1.105 . . . . 0.0 110.332 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.18 -35.96 28.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.354 -0.841 . . . . 0.0 110.733 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -75.01 -43.79 51.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.154 -0.966 . . . . 0.0 110.64 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 47.6 m -57.86 -27.01 62.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.206 -0.934 . . . . 0.0 110.507 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.769 ' HA ' HD12 ' A' ' 17' ' ' LEU . 15.7 mt -82.67 -34.45 27.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -59.78 -39.12 83.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 110.117 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.505 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 35.9 t -70.21 -37.84 75.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.407 -0.808 . . . . 0.0 110.571 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.769 HD12 ' HA ' ' A' ' 14' ' ' LEU . 22.7 mt -58.66 -50.56 73.41 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.086 -1.009 . . . . 0.0 110.166 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.408 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 18.1 ttm105 -46.98 -29.15 1.91 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.367 -0.833 . . . . 0.0 110.307 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 72.0 t80 -64.81 -42.12 95.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.234 -0.916 . . . . 0.0 110.503 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 mtt-85 -70.99 -26.24 63.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.926 . . . . 0.0 110.157 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.1 m-30 -66.55 -20.37 66.0 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.217 -0.927 . . . . 0.0 110.398 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -63.29 -27.7 69.51 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.224 -0.923 . . . . 0.0 110.42 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.6 mmtm -75.13 -48.4 23.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.476 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.431 ' CB ' HD12 ' A' ' 27' ' ' LEU . 20.1 m-70 -94.84 52.85 1.53 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.204 -0.935 . . . . 0.0 110.228 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.4 p -57.7 -13.65 4.38 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.154 -0.966 . . . . 0.0 110.742 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.86 13.4 28.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.025 -1.047 . . . . 0.0 110.699 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.618 HD11 ' OE1' ' A' ' 65' ' ' GLN . 3.6 mt -92.06 -45.11 8.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.122 -0.986 . . . . 0.0 110.089 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.769 ' CE2' HG23 ' A' ' 31' ' ' VAL . 28.6 p90 -106.12 172.66 6.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.328 -0.857 . . . . 0.0 109.584 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -100.41 -35.52 9.54 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.864 -1.148 . . . . 0.0 110.99 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 119.84 2.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.091 -1.006 . . . . 0.0 110.81 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.769 HG23 ' CE2' ' A' ' 28' ' ' TYR . 47.1 t -88.42 99.96 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.309 -0.869 . . . . 0.0 110.18 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.775 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -62.12 151.28 36.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 111.663 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.542 ' O ' HG23 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -61.69 159.1 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.441 -0.787 . . . . 0.0 109.761 179.023 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.2 127.6 33.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.773 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 58.6 p-90 -146.39 120.63 9.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.085 -1.009 . . . . 0.0 110.634 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.507 ' HA ' ' HB ' ' A' ' 48' ' ' ILE . 29.3 t-80 -78.94 166.44 22.38 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.032 -1.043 . . . . 0.0 109.913 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.569 ' CZ2' HG23 ' B' ' 52' ' ' THR . 0.0 OUTLIER -78.41 50.7 0.96 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.817 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.445 ' C ' ' O ' ' B' ' 31' ' ' VAL . 13.0 t . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.149 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.231 0.538 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.622 HD11 ' HD2' ' A' ' 8' ' ' LYS . 80.1 mt -142.27 133.75 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.22 -0.925 . . . . 0.0 110.068 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -125.14 -179.38 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.9 -1.125 . . . . 0.0 110.308 -179.932 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.415 ' N ' HG13 ' A' ' 49' ' ' VAL . 16.8 m -145.06 158.2 43.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.409 -0.807 . . . . 0.0 109.818 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 31' ' ' VAL . 27.0 mt -135.04 131.52 37.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.231 -0.918 . . . . 0.0 110.009 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.463 HG23 ' CZ2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.83 130.56 44.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 110.263 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.415 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 35.0 m-85 -117.8 152.86 34.48 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.387 -0.82 . . . . 0.0 109.986 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -95.48 -18.35 20.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.362 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 77.3 p -145.43 140.44 27.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -61.12 -39.58 90.55 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 0.0 110.226 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.9 t-105 -53.96 -50.45 66.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.286 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.423 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 60.2 tt0 -57.27 -40.1 77.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.424 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -59.32 -38.99 81.7 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.128 -0.983 . . . . 0.0 110.168 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.833 ' HA ' HD12 ' A' ' 63' ' ' LEU . 42.6 m-20 -61.34 -41.42 97.01 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.865 . . . . 0.0 110.53 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.454 ' O ' ' OG ' ' A' ' 64' ' ' SER . 43.5 mt-30 -65.7 -40.08 91.91 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.159 -0.963 . . . . 0.0 110.201 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.775 ' O ' HG22 ' A' ' 66' ' ' VAL . 68.3 t80 -55.76 -42.07 74.92 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.263 -0.898 . . . . 0.0 109.942 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.833 HD12 ' HA ' ' A' ' 60' ' ' ASP . 12.0 mt -59.44 -24.0 63.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.454 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 3.7 p -100.08 -7.89 24.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 110.179 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.618 ' OE1' HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -97.07 -29.31 13.7 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.314 -0.867 . . . . 0.0 109.818 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.784 ' O ' HG23 ' A' ' 66' ' ' VAL . 19.1 m -110.04 85.36 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.644 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -35.59 104.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.557 -0.715 . . . . 0.0 110.479 -179.517 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 66' ' ' VAL . 82.3 mt -87.67 115.03 61.61 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.176 -0.953 . . . . 0.0 110.467 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -63.4 -158.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 124.073 1.565 . . . . 0.0 110.082 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -106.54 -13.1 15.42 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.108 -0.995 . . . . 0.0 110.328 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.2 p -84.59 -21.97 30.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.639 HD12 HD21 ' A' ' 14' ' ' LEU . 25.1 mm -93.75 108.34 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.285 -0.884 . . . . 0.0 109.858 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.7 m -96.14 153.72 17.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.192 -0.943 . . . . 0.0 110.241 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.663 ' CG1' HG13 ' A' ' 5' ' ' VAL . 6.9 t -145.26 156.17 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.228 -0.92 . . . . 0.0 110.717 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -138.42 -179.07 5.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.51 -0.744 . . . . 0.0 110.061 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' B' ' 80' ' ' SER . 1.6 p -106.31 154.54 20.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.201 -0.937 . . . . 0.0 110.467 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.433 ' C ' HG12 ' A' ' 4' ' ' ILE . . . -161.13 175.3 37.78 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.458 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 79.7 m-85 -147.92 137.88 22.68 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.182 -1.187 . . . . 0.0 110.44 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 7.9 mtt -115.14 162.2 17.37 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.342 -0.849 . . . . 0.0 109.814 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.444 ' O ' HG23 ' A' ' 81' ' ' ILE . 12.4 t -118.66 99.37 6.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.23 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.444 HG23 ' O ' ' A' ' 80' ' ' SER . 1.7 pt . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.248 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.448 ' HB3' ' HB3' ' B' ' 78' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.213 0.53 . . . . 0.0 110.224 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 2' ' ' THR . . . . . 0.457 ' O ' HG23 ' B' ' 4' ' ' ILE . 63.6 p -96.77 106.5 30.72 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.204 -0.935 . . . . 0.0 110.308 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.424 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 48.4 Cg_endo -52.54 155.96 9.3 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.021 1.538 . . . . 0.0 110.302 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.457 HG23 ' O ' ' B' ' 2' ' ' THR . 7.6 pt -143.4 178.48 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.203 -0.936 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.665 HG13 ' CG1' ' B' ' 74' ' ' VAL . 39.8 t -145.64 136.04 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.878 . . . . 0.0 110.257 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.556 ' O ' HG22 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.94 121.1 43.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.365 -0.834 . . . . 0.0 109.783 179.857 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.625 HD12 HG12 ' B' ' 5' ' ' VAL . 0.5 OUTLIER -115.08 124.23 51.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.57 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.601 ' HD2' HD11 ' B' ' 48' ' ' ILE . 18.8 tttt -141.38 166.08 25.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -0.879 . . . . 0.0 110.196 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.53 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 142.04 -146.3 17.21 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.68 121.85 15.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.346 -1.091 . . . . 0.0 110.324 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.71 -35.49 31.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 110.725 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -75.42 -43.59 49.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.175 -0.953 . . . . 0.0 110.561 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 44.4 m -57.86 -28.18 63.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.173 -0.954 . . . . 0.0 110.403 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.76 ' HA ' HD12 ' B' ' 17' ' ' LEU . 13.0 mt -81.9 -34.66 29.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.077 -1.015 . . . . 0.0 110.117 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -59.74 -38.85 82.88 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.326 -0.859 . . . . 0.0 110.171 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.503 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 36.3 t -70.2 -37.71 75.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 0.0 110.485 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.76 HD12 ' HA ' ' B' ' 14' ' ' LEU . 23.0 mt -58.76 -50.61 73.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.142 -0.974 . . . . 0.0 110.107 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -47.16 -28.65 1.91 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.433 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.503 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 72.0 t80 -64.84 -41.92 95.34 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.317 -0.864 . . . . 0.0 110.469 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 26.2 mtt-85 -71.27 -26.42 62.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.0 110.364 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.552 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.5 m-30 -66.64 -20.17 65.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.27 -0.894 . . . . 0.0 110.359 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -63.38 -27.44 69.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.139 -0.976 . . . . 0.0 110.459 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -75.16 -48.32 24.18 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.264 -0.898 . . . . 0.0 110.512 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.423 ' CB ' HD12 ' B' ' 27' ' ' LEU . 18.9 m-70 -94.93 52.88 1.51 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.249 -0.907 . . . . 0.0 110.22 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 p -57.47 -13.72 3.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.29 -0.881 . . . . 0.0 110.558 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.96 13.58 28.42 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.128 -0.982 . . . . 0.0 110.817 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.648 HD11 ' OE1' ' B' ' 65' ' ' GLN . 3.6 mt -92.32 -44.13 8.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.071 -1.018 . . . . 0.0 109.97 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.774 ' CE2' HG23 ' B' ' 31' ' ' VAL . 27.8 p90 -107.14 173.33 6.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.256 -0.903 . . . . 0.0 109.536 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.2 m -100.86 -35.79 9.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.054 -1.029 . . . . 0.0 110.919 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.76 119.86 2.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.165 -0.959 . . . . 0.0 110.684 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.774 HG23 ' CE2' ' B' ' 28' ' ' TYR . 48.5 t -88.19 99.68 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.089 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.773 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -60.78 150.13 33.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 111.485 -179.49 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 33' ' ' SER . . . . . 0.576 ' O ' HG23 ' B' ' 49' ' ' VAL . 0.3 OUTLIER -61.7 159.65 13.1 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.551 -0.718 . . . . 0.0 109.575 179.107 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.405 ' HA ' HG23 ' B' ' 49' ' ' VAL . 0.5 OUTLIER -68.25 127.41 32.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.036 -1.04 . . . . 0.0 110.616 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.775 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 58.4 p-90 -146.22 120.73 9.72 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.024 -1.047 . . . . 0.0 110.701 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.491 ' HA ' ' HB ' ' B' ' 48' ' ' ILE . 29.8 t-80 -78.86 166.48 22.38 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.933 -1.104 . . . . 0.0 109.902 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.579 ' HA ' ' CE3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -78.57 50.93 1.01 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.102 -0.998 . . . . 0.0 110.129 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 38' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 31' ' ' VAL . 13.6 t . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.32 -0.863 . . . . 0.0 110.184 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.321 0.581 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.601 HD11 ' HD2' ' B' ' 8' ' ' LYS . 85.3 mt -142.38 134.23 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.326 -0.859 . . . . 0.0 109.799 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 49' ' ' VAL . . . . . 0.576 HG23 ' O ' ' B' ' 33' ' ' SER . 0.3 OUTLIER -125.91 -179.4 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.841 -1.162 . . . . 0.0 110.306 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.401 ' N ' HG13 ' B' ' 49' ' ' VAL . 17.1 m -145.03 158.43 43.82 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.318 -0.863 . . . . 0.0 109.97 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' B' ' 31' ' ' VAL . 25.2 mt -134.97 131.44 37.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.23 -0.919 . . . . 0.0 109.982 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.569 HG23 ' CZ2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.62 130.77 43.76 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.313 -0.867 . . . . 0.0 110.167 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.424 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 35.5 m-85 -118.07 153.3 33.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.346 -0.846 . . . . 0.0 110.003 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -95.4 -18.49 20.69 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.25 -0.906 . . . . 0.0 110.397 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 p -145.32 140.33 27.66 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.152 -0.967 . . . . 0.0 110.307 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.1 -39.3 89.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.288 -0.883 . . . . 0.0 110.044 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -54.12 -50.99 65.64 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.232 -0.917 . . . . 0.0 110.237 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.425 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 60.9 tt0 -57.08 -39.7 75.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.409 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -59.69 -38.86 82.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.085 -1.009 . . . . 0.0 110.006 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.859 ' HA ' HD12 ' B' ' 63' ' ' LEU . 43.4 m-20 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.416 -0.803 . . . . 0.0 110.441 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.448 ' O ' ' OG ' ' B' ' 64' ' ' SER . 44.1 mt-30 -65.83 -40.0 91.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.252 -0.905 . . . . 0.0 110.283 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.798 ' O ' HG22 ' B' ' 66' ' ' VAL . 69.5 t80 -55.83 -41.68 74.6 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 109.754 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.859 HD12 ' HA ' ' B' ' 60' ' ' ASP . 13.0 mt -59.51 -24.58 63.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.336 -0.852 . . . . 0.0 110.049 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.448 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 3.9 p -99.87 -7.9 24.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.299 -0.876 . . . . 0.0 110.144 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 65' ' ' GLN . . . . . 0.648 ' OE1' HD11 ' B' ' 27' ' ' LEU . 0.9 OUTLIER -97.08 -29.13 13.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.303 -0.873 . . . . 0.0 109.881 179.739 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.798 HG22 ' O ' ' B' ' 62' ' ' PHE . 20.3 m -110.0 83.58 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.323 -0.861 . . . . 0.0 109.912 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.55 ' O ' ' CG ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -33.47 104.14 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.497 -0.752 . . . . 0.0 110.627 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.508 HG13 ' O ' ' B' ' 66' ' ' VAL . 84.8 mt -87.89 114.49 59.38 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 110.534 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.75 -159.03 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.845 0 O-C-N 124.211 1.637 . . . . 0.0 110.236 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -106.24 -12.84 15.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.184 -0.948 . . . . 0.0 110.492 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 29.9 p -84.69 -21.97 29.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.161 -0.962 . . . . 0.0 110.13 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.641 HD12 HD21 ' B' ' 14' ' ' LEU . 24.8 mm -94.12 108.5 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.287 -0.883 . . . . 0.0 109.751 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -96.09 153.64 17.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.109 -0.995 . . . . 0.0 110.07 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.665 ' CG1' HG13 ' B' ' 5' ' ' VAL . 6.0 t -144.99 155.98 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.107 -0.995 . . . . 0.0 110.546 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 3.3 t -138.6 -178.92 5.52 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.154 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -106.15 154.04 21.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.306 -0.871 . . . . 0.0 110.592 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.448 ' C ' HG12 ' B' ' 4' ' ' ILE . . . -160.75 174.91 37.47 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.448 ' HB3' ' HB3' ' B' ' 1' ' ' MET . 80.1 m-85 -147.99 138.07 22.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.212 -1.169 . . . . 0.0 110.416 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 7.7 mtt -115.3 161.69 18.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.208 -0.933 . . . . 0.0 109.935 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.467 ' HB3' ' O ' ' A' ' 76' ' ' THR . 13.1 t -118.37 98.95 6.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.184 -0.948 . . . . 0.0 110.168 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.445 HG23 ' O ' ' B' ' 80' ' ' SER . 1.6 pt . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.069 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 mtp . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.253 0.549 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.658 ' O ' HG23 ' A' ' 2' ' ' THR . 5.5 t -100.95 103.83 27.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.274 -0.891 . . . . 0.0 110.419 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 48.8 Cg_endo -49.33 157.94 1.83 Allowed 'Trans proline' 0 C--N 1.305 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.238 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.698 ' O ' HD12 ' A' ' 4' ' ' ILE . 2.3 pp -143.91 119.02 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.131 -0.981 . . . . 0.0 110.488 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.455 HG13 ' CG2' ' A' ' 74' ' ' VAL . 1.2 t -94.08 136.57 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.226 -0.921 . . . . 0.0 110.257 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.47 138.62 41.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.301 -0.874 . . . . 0.0 109.695 179.529 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.584 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.3 OUTLIER -129.57 131.13 46.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.958 -1.089 . . . . 0.0 110.569 -179.55 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 14.4 ttpp -141.52 167.02 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.29 -0.881 . . . . 0.0 109.951 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.432 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 145.6 -151.06 23.31 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.781 -1.327 . . . . 0.0 109.781 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 13' ' ' THR . 8.3 m-20 -65.33 127.22 30.88 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.317 -1.108 . . . . 0.0 110.715 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.62 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.32 -68.81 0.14 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 0.0 110.398 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -46.0 -43.61 14.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 110.177 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.485 HG22 HD11 ' A' ' 72' ' ' ILE . 22.3 m -57.94 -18.25 22.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 110.104 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.947 ' HA ' HD12 ' A' ' 17' ' ' LEU . 19.7 mt -91.53 -29.88 16.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.306 -0.871 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.0 mmtt -59.03 -41.43 87.77 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.204 -0.935 . . . . 0.0 110.481 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 t -69.74 -36.49 75.89 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.381 -0.824 . . . . 0.0 110.547 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.947 HD12 ' HA ' ' A' ' 14' ' ' LEU . 46.0 mt -58.92 -54.49 46.55 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.04 -1.038 . . . . 0.0 110.36 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -45.81 -32.1 2.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.307 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.82 -29.34 70.29 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.215 -0.928 . . . . 0.0 110.213 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -69.87 -21.8 63.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.025 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.708 ' CE2' HD21 ' A' ' 51' ' ' LEU . 10.2 m-30 -66.47 -36.41 82.68 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 110.045 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -63.61 -33.79 76.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.429 -0.795 . . . . 0.0 110.218 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -74.96 -9.43 58.53 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.207 -0.933 . . . . 0.0 109.863 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.551 ' HB3' HD12 ' A' ' 27' ' ' LEU . 99.1 m-70 -145.04 43.53 1.33 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.831 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.485 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.8 t -57.74 -8.58 0.95 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.421 -0.8 . . . . 0.0 111.039 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.6 p -95.78 7.69 45.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.93 -1.106 . . . . 0.0 110.292 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.551 HD12 ' HB3' ' A' ' 24' ' ' HIS . 5.0 mt -92.33 -54.87 3.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 0.0 109.864 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.639 ' CD1' HG13 ' A' ' 31' ' ' VAL . 31.7 p90 -93.65 169.84 10.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.1 m -100.61 -33.24 10.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.081 -1.012 . . . . 0.0 110.811 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.49 114.7 2.44 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.959 -1.088 . . . . 0.0 110.748 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.68 HG12 ' CD2' ' A' ' 51' ' ' LEU . 20.5 m -90.57 112.9 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 110.187 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.568 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -68.45 147.94 51.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.157 -0.964 . . . . 0.0 110.342 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -61.5 159.64 12.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.895 ' HA ' HG23 ' A' ' 49' ' ' VAL . 91.7 m -68.18 134.86 51.16 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.356 -0.84 . . . . 0.0 110.447 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.59 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 60.2 p-90 -146.66 -178.39 6.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 0.0 109.564 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.576 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 70.6 t60 -162.43 174.23 13.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.893 -1.129 . . . . 0.0 110.66 -179.392 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 74.7 m95 -78.65 103.41 8.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.274 -0.891 . . . . 0.0 110.281 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.448 ' O ' HG23 ' B' ' 31' ' ' VAL . 3.0 p . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.349 -0.844 . . . . 0.0 110.217 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.373 0.606 . . . . 0.0 110.567 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.584 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.9 mt -143.85 148.48 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.41 -0.806 . . . . 0.0 109.939 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.895 HG23 ' HA ' ' A' ' 34' ' ' THR . 0.4 OUTLIER -128.16 -179.48 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.1 -1.0 . . . . 0.0 110.276 -179.899 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.566 ' N ' HG13 ' A' ' 49' ' ' VAL . 96.4 m -145.98 154.05 41.47 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.256 -0.903 . . . . 0.0 110.009 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.708 HD21 ' CE2' ' A' ' 21' ' ' PHE . 17.7 mt -132.91 124.09 27.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.148 -0.97 . . . . 0.0 110.24 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 132.88 42.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.28 -0.887 . . . . 0.0 110.263 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 45.0 m-85 -117.73 153.87 32.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -0.876 . . . . 0.0 110.188 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -85.25 -9.99 57.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 110.574 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -162.46 160.43 26.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.135 -0.978 . . . . 0.0 110.238 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -70.99 -37.85 72.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.18 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -53.97 -52.38 60.87 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 21.5 tt0 -58.08 -36.03 72.26 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.335 -0.853 . . . . 0.0 110.624 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp85 -59.13 -54.13 50.46 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.101 -0.999 . . . . 0.0 110.601 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.551 ' HA ' HD12 ' A' ' 63' ' ' LEU . 2.2 t70 -61.05 -26.34 67.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.201 -0.937 . . . . 0.0 110.364 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 46.7 mt-30 -65.54 -54.89 21.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 109.785 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 1.067 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.8 t80 -55.63 -39.74 71.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.905 . . . . 0.0 109.832 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 60' ' ' ASP . 9.2 mt -59.19 -23.64 62.42 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 110.068 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.71 -18.69 21.06 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.31 -0.869 . . . . 0.0 110.149 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -93.93 -9.05 38.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.178 -0.951 . . . . 0.0 109.89 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 1.067 HG22 ' O ' ' A' ' 62' ' ' PHE . 34.0 m -136.41 133.09 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.367 -0.833 . . . . 0.0 109.811 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 103.08 11.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.241 -0.912 . . . . 0.0 109.785 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.722 ' CG2' HD12 ' A' ' 72' ' ' ILE . 18.1 mt -88.08 130.94 44.4 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.437 -0.789 . . . . 0.0 110.336 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.55 ' HD2' ' CG2' ' A' ' 68' ' ' ILE . 41.6 Cg_endo -40.53 162.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.639 0 O-C-N 123.969 1.51 . . . . 0.0 110.463 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -74.99 3.35 8.5 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.298 -0.876 . . . . 0.0 110.882 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -24.87 28.79 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.043 -1.035 . . . . 0.0 109.842 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.722 HD12 ' CG2' ' A' ' 68' ' ' ILE . 81.2 mt -95.41 109.11 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.51 -0.743 . . . . 0.0 110.503 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 79.4 m -96.14 157.0 16.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.219 -0.926 . . . . 0.0 110.451 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 6' ' ' HIS . 3.4 p -143.07 136.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.106 -0.996 . . . . 0.0 111.409 -179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.23 -179.53 4.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.294 0.568 . . . . 0.0 110.141 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 50.2 p -128.94 154.33 46.66 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.306 -0.871 . . . . 0.0 109.96 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -171.54 -170.33 35.46 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.414 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 56.2 m-85 -147.53 150.63 34.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.355 -1.085 . . . . 0.0 110.32 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 1.1 ttt -124.61 167.61 14.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.235 -0.915 . . . . 0.0 109.989 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 27.4 t -131.47 103.68 6.56 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.0 110.309 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.603 ' O ' HG23 ' A' ' 81' ' ' ILE . 6.5 tt . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.257 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 mtp . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.247 0.546 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 2' ' ' THR . . . . . 0.652 ' O ' HG23 ' B' ' 2' ' ' THR . 5.4 t -101.31 104.46 33.47 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 110.401 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.525 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -50.16 157.63 2.86 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 123.974 1.513 . . . . 0.0 110.114 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.683 ' O ' HD12 ' B' ' 4' ' ' ILE . 2.3 pp -143.87 119.05 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.217 -0.927 . . . . 0.0 110.325 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.437 HG13 ' CG2' ' B' ' 74' ' ' VAL . 1.1 t -94.11 136.11 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.262 -0.899 . . . . 0.0 110.301 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.503 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.2 138.57 41.19 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.29 -0.881 . . . . 0.0 109.666 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.608 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.3 OUTLIER -129.77 131.4 46.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.004 -1.06 . . . . 0.0 110.607 -179.484 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 15.0 ttpp -141.43 167.17 22.8 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.983 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.43 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 145.66 -151.53 23.72 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 10' ' ' ASP . . . . . 0.411 ' O ' ' HB ' ' B' ' 13' ' ' THR . 9.6 m-20 -64.93 127.25 30.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.275 -1.132 . . . . 0.0 110.655 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.635 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.34 -68.99 0.13 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.275 -0.89 . . . . 0.0 110.282 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 12' ' ' ASN . . . . . 0.411 ' OD1' ' N ' ' B' ' 13' ' ' THR . 10.3 p30 -45.71 -43.93 13.2 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.496 HG22 HD11 ' B' ' 72' ' ' ILE . 22.2 m -57.83 -18.02 19.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.289 -0.882 . . . . 0.0 110.096 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.946 ' HA ' HD12 ' B' ' 17' ' ' LEU . 18.6 mt -91.74 -29.63 16.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.254 -0.904 . . . . 0.0 110.337 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.5 mmtt -59.17 -41.17 87.8 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.331 -0.856 . . . . 0.0 110.519 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 15.8 t -69.96 -36.56 75.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.368 -0.832 . . . . 0.0 110.564 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.946 HD12 ' HA ' ' B' ' 14' ' ' LEU . 44.4 mt -59.04 -54.12 50.68 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.115 -0.991 . . . . 0.0 110.495 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -46.08 -31.99 2.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.838 . . . . 0.0 110.332 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.89 -29.85 70.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.161 -0.962 . . . . 0.0 110.081 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -69.6 -21.95 63.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.262 -0.899 . . . . 0.0 110.008 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.7 ' CE2' HD21 ' B' ' 51' ' ' LEU . 10.2 m-30 -66.48 -36.3 82.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.87 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -63.71 -34.0 76.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.377 -0.827 . . . . 0.0 110.222 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -74.88 -9.3 58.41 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.161 -0.962 . . . . 0.0 109.753 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.535 ' HB3' HD12 ' B' ' 27' ' ' LEU . 99.0 m-70 -145.16 43.66 1.32 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.379 -0.826 . . . . 0.0 109.948 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.467 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.8 t -57.73 -8.9 1.02 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.341 -0.849 . . . . 0.0 111.136 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 68.9 p -95.38 7.62 45.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.959 -1.088 . . . . 0.0 110.327 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.535 HD12 ' HB3' ' B' ' 24' ' ' HIS . 5.0 mt -92.41 -54.49 3.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.878 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.65 ' CD1' HG13 ' B' ' 31' ' ' VAL . 31.6 p90 -93.7 169.46 10.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.273 -0.892 . . . . 0.0 109.779 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 5.5 m -100.53 -33.15 10.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.116 -0.99 . . . . 0.0 110.815 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.44 114.55 2.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.1 -1.0 . . . . 0.0 110.843 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.688 HG12 ' CD2' ' B' ' 51' ' ' LEU . 17.0 m -90.6 111.63 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.405 -0.809 . . . . 0.0 110.119 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.59 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -67.6 148.33 51.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.11 -0.994 . . . . 0.0 110.502 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 33' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -61.6 158.96 14.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.344 -0.847 . . . . 0.0 110.245 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.883 ' HA ' HG23 ' B' ' 49' ' ' VAL . 86.1 m -68.18 134.9 51.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.317 -0.864 . . . . 0.0 110.602 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.568 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 59.5 p-90 -146.75 -178.17 6.04 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 109.549 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.583 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 70.4 t60 -162.35 174.44 12.79 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.828 -1.17 . . . . 0.0 110.685 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.583 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 73.5 m95 -78.54 103.57 8.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.183 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 31' ' ' VAL . 3.0 p . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.268 -0.895 . . . . 0.0 110.167 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.519 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.444 0.64 . . . . 0.0 110.44 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.608 HG23 ' O ' ' B' ' 7' ' ' LEU . 44.5 mt -143.93 148.22 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 0.0 110.024 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 49' ' ' VAL . . . . . 0.883 HG23 ' HA ' ' B' ' 34' ' ' THR . 0.4 OUTLIER -127.47 -179.33 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.134 -0.979 . . . . 0.0 110.193 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.585 ' N ' HG13 ' B' ' 49' ' ' VAL . 93.4 m -145.73 154.27 41.87 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.7 HD21 ' CE2' ' B' ' 21' ' ' PHE . 18.9 mt -133.14 123.53 25.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.052 -1.03 . . . . 0.0 110.207 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.12 133.69 41.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 110.201 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.525 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 44.2 m-85 -118.91 154.41 33.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.275 -0.891 . . . . 0.0 110.226 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.09 -10.66 56.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 0.0 110.522 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -162.16 160.71 27.51 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.08 -1.012 . . . . 0.0 110.434 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 78.5 mt-10 -70.72 -38.81 73.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.238 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -53.63 -52.18 60.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 110.229 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.482 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 21.9 tt0 -58.25 -35.93 72.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.602 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 13.2 ttp85 -59.19 -54.33 48.21 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.054 -1.028 . . . . 0.0 110.68 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.538 ' HA ' HD12 ' B' ' 63' ' ' LEU . 2.5 t70 -61.0 -26.1 67.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 110.295 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 45.3 mt-30 -65.54 -54.89 21.64 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.22 -0.925 . . . . 0.0 109.915 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 1.046 ' O ' HG22 ' B' ' 66' ' ' VAL . 1.7 t80 -55.67 -39.95 71.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.833 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' B' ' 60' ' ' ASP . 9.0 mt -59.19 -23.61 62.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.3 -0.875 . . . . 0.0 110.044 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.22 -18.95 21.18 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.217 -0.927 . . . . 0.0 110.362 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -94.43 -8.34 38.88 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.209 -0.932 . . . . 0.0 110.042 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 1.046 HG22 ' O ' ' B' ' 62' ' ' PHE . 33.6 m -136.7 132.79 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.362 -0.836 . . . . 0.0 109.676 179.512 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 103.05 11.19 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.346 -0.846 . . . . 0.0 109.793 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.679 ' CG2' HD12 ' B' ' 72' ' ' ILE . 18.2 mt -87.98 130.67 45.61 Favored Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.297 -0.877 . . . . 0.0 110.215 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.55 ' HD2' ' CG2' ' B' ' 68' ' ' ILE . 40.7 Cg_endo -40.56 163.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 O-C-N 123.889 1.468 . . . . 0.0 110.501 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -75.47 3.03 10.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.334 -0.854 . . . . 0.0 111.008 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.56 -24.83 29.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.052 -1.03 . . . . 0.0 109.902 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.679 HD12 ' CG2' ' B' ' 68' ' ' ILE . 84.4 mt -95.55 108.6 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 110.417 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 89.9 m -95.83 157.31 15.95 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.41 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 6' ' ' HIS . 3.2 p -143.29 137.37 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 111.539 -179.003 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.22 -179.4 3.94 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.343 0.592 . . . . 0.0 110.167 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 46.5 p -128.83 154.37 46.51 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 109.929 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.419 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -171.72 -170.16 35.39 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.419 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 57.7 m-85 -147.58 151.25 35.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.33 -1.1 . . . . 0.0 110.284 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -125.16 167.14 15.23 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 0.0 109.982 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 27.3 t -131.06 103.95 6.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.097 -1.002 . . . . 0.0 110.284 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.619 HG23 ' O ' ' B' ' 81' ' ' ILE . 6.7 tt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.232 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mtp . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.72 ' O ' HG23 ' A' ' 2' ' ' THR . 15.1 t -92.0 113.78 60.04 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.978 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.502 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -62.55 160.33 32.54 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.894 1.47 . . . . 0.0 110.281 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.436 HG21 ' SD ' ' A' ' 79' ' ' MET . 1.0 OUTLIER -143.29 122.37 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.372 -0.83 . . . . 0.0 109.939 179.736 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.72 HG13 ' CG2' ' A' ' 74' ' ' VAL . 85.5 t -94.28 130.08 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.2 -0.937 . . . . 0.0 110.616 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.546 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.83 122.22 45.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.245 -0.909 . . . . 0.0 109.729 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.533 ' HG ' ' CG2' ' A' ' 72' ' ' ILE . 0.7 OUTLIER -115.67 135.97 53.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 0.0 110.792 -179.35 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.492 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 4.3 ttpp -140.65 166.18 25.44 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.216 -0.928 . . . . 0.0 109.834 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.46 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 150.9 -156.14 26.52 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -64.97 130.66 44.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.344 -1.092 . . . . 0.0 110.666 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.54 -63.1 1.23 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.301 -0.874 . . . . 0.0 110.551 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -44.87 -47.29 11.14 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 0.0 110.58 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.449 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 97.0 m -57.77 -30.52 65.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.16 -0.963 . . . . 0.0 110.545 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.968 ' HA ' HD12 ' A' ' 17' ' ' LEU . 6.8 mt -70.59 -33.51 71.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.17 -0.956 . . . . 0.0 110.263 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.51 -44.14 93.22 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.237 -0.914 . . . . 0.0 110.753 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 21.5 t -69.82 -38.24 76.51 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.246 -0.909 . . . . 0.0 110.856 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.968 HD12 ' HA ' ' A' ' 14' ' ' LEU . 21.6 mt -58.81 -56.19 25.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.561 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -45.95 -28.22 1.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.0 110.29 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.461 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 61.0 t80 -64.82 -31.12 72.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.176 -0.953 . . . . 0.0 109.903 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -67.61 -21.77 65.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.317 -0.864 . . . . 0.0 110.07 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.493 ' CE2' HD21 ' A' ' 51' ' ' LEU . 10.2 m-30 -66.25 -36.43 82.99 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.026 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -63.52 -41.0 98.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.277 -0.889 . . . . 0.0 110.031 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.06 -2.09 25.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.188 -0.945 . . . . 0.0 109.847 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.487 ' HB3' HD12 ' A' ' 27' ' ' LEU . 84.8 m-70 -144.69 35.48 1.16 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.412 -0.805 . . . . 0.0 109.351 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.524 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.6 t -57.55 -9.41 1.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.576 -0.702 . . . . 0.0 111.054 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.4 p -95.51 4.9 52.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.986 -1.071 . . . . 0.0 110.411 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.507 ' HA ' HD23 ' A' ' 27' ' ' LEU . 8.8 mt -92.59 -48.78 6.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.161 -0.962 . . . . 0.0 110.171 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.524 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 10.2 p90 -100.67 165.78 11.22 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.974 . . . . 0.0 109.755 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 m -101.33 -30.32 11.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.93 -1.106 . . . . 0.0 110.887 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.3 111.38 2.13 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.048 -1.033 . . . . 0.0 110.899 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.47 HG12 HD23 ' A' ' 51' ' ' LEU . 31.9 m -90.58 140.63 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.27 -0.894 . . . . 0.0 110.02 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.6 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.0 OUTLIER -90.89 145.56 24.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 162.12 8.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.247 -0.908 . . . . 0.0 110.43 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.5 m -68.32 132.5 47.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.276 -0.89 . . . . 0.0 110.475 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.622 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 55.5 p-90 -146.81 -178.33 6.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 109.826 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.638 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 25.6 t60 -162.35 174.43 12.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.001 -1.062 . . . . 0.0 110.719 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.638 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 34.4 m95 -78.57 98.28 6.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.519 -0.738 . . . . 0.0 110.024 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.8 p . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 110.225 -179.994 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.506 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.416 0.627 . . . . 0.0 110.415 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.502 HG13 ' C ' ' A' ' 47' ' ' ALA . 19.6 mt -143.95 167.81 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 110.032 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 50' ' ' THR . 0.3 OUTLIER -147.16 -179.75 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.055 -1.028 . . . . 0.0 110.294 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.434 ' O ' ' OG ' ' A' ' 32' ' ' SER . 87.5 m -146.55 156.66 43.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.88 . . . . 0.0 109.945 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.493 HD21 ' CE2' ' A' ' 21' ' ' PHE . 1.5 mt -134.77 125.19 26.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.071 -1.018 . . . . 0.0 110.061 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 134.58 40.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.29 -0.882 . . . . 0.0 110.456 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.502 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 47.1 m-85 -120.25 154.83 34.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.232 -0.917 . . . . 0.0 110.308 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -86.4 -10.06 55.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 110.572 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.72 150.53 17.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.135 -0.978 . . . . 0.0 110.404 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 24.7 mt-10 -64.08 -39.08 93.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.898 . . . . 0.0 109.992 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.433 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 61.8 t-105 -53.57 -52.13 60.72 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.301 -0.874 . . . . 0.0 109.881 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.441 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 13.8 tt0 -57.37 -35.45 69.98 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.383 -0.823 . . . . 0.0 110.483 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 21.5 ttp85 -59.63 -50.45 73.81 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.083 -1.011 . . . . 0.0 110.966 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -60.93 -33.09 72.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.177 -0.952 . . . . 0.0 110.796 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 57' ' ' TRP . 35.1 mt-30 -65.62 -47.34 75.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.158 -0.964 . . . . 0.0 110.207 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.989 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.0 OUTLIER -55.69 -44.0 76.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 110.033 179.714 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.6 mt -59.22 -35.62 73.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.282 -0.886 . . . . 0.0 110.491 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.7 t -77.72 -18.9 56.07 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.147 -0.971 . . . . 0.0 110.449 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -94.63 -9.44 35.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.621 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.989 HG22 ' O ' ' A' ' 62' ' ' PHE . 27.5 m -141.91 92.92 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.042 -1.036 . . . . 0.0 110.545 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -76.18 113.16 13.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.17 -0.956 . . . . 0.0 109.933 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.862 HG22 ' HD2' ' A' ' 69' ' ' PRO . 0.0 OUTLIER -89.76 162.94 34.5 Favored Pre-proline 0 N--CA 1.498 1.939 0 O-C-N 121.096 -1.003 . . . . 0.0 109.765 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.862 ' HD2' HG22 ' A' ' 68' ' ' ILE . 46.7 Cg_endo -60.93 -178.9 0.25 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.893 1.47 . . . . 0.0 110.133 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -91.97 -6.15 51.79 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 110.44 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.0 m -84.58 -20.35 31.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.0 110.022 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.533 ' CG2' ' HG ' ' A' ' 7' ' ' LEU . 33.0 mt -94.38 107.18 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.276 -0.89 . . . . 0.0 110.204 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -95.44 157.38 15.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 111.055 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.72 ' CG2' HG13 ' A' ' 5' ' ' VAL . 8.8 p -142.2 130.66 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.938 0.875 . . . . 0.0 111.24 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.75 172.79 6.64 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.311 0.577 . . . . 0.0 110.474 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.9 p -111.54 144.33 40.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.393 -0.817 . . . . 0.0 109.975 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -154.61 176.22 32.45 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -147.72 146.75 29.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.316 -1.108 . . . . 0.0 110.139 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.436 ' SD ' HG21 ' A' ' 4' ' ' ILE . 25.2 mtt -120.22 176.97 5.19 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.097 -1.002 . . . . 0.0 110.324 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.9 t -139.67 107.33 5.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.315 -0.866 . . . . 0.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.309 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mtp . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.217 0.532 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 2' ' ' THR . . . . . 0.716 ' O ' HG23 ' B' ' 2' ' ' THR . 15.2 t -92.21 113.82 60.35 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.23 -0.919 . . . . 0.0 109.94 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -62.4 160.15 32.72 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 123.999 1.526 . . . . 0.0 110.333 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.471 HG21 ' SD ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -143.31 122.02 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.251 -0.906 . . . . 0.0 109.896 179.768 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.732 HG13 ' CG2' ' B' ' 74' ' ' VAL . 85.0 t -94.13 130.02 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.676 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.537 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.5 122.97 47.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.279 -0.888 . . . . 0.0 109.565 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.547 ' HG ' ' CG2' ' B' ' 72' ' ' ILE . 0.7 OUTLIER -116.28 135.65 53.7 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.174 -0.954 . . . . 0.0 110.777 -179.427 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.499 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 4.4 ttpp -140.66 165.42 27.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 109.959 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.442 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 151.58 -155.78 26.33 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -65.0 130.96 45.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -1.117 . . . . 0.0 110.644 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.507 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.75 -62.66 1.47 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.393 -0.817 . . . . 0.0 110.613 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -45.64 -46.61 14.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 0.0 110.673 -179.603 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.423 HG22 HD11 ' B' ' 17' ' ' LEU . 97.1 m -58.09 -30.6 66.37 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.226 -0.921 . . . . 0.0 110.493 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.952 ' HA ' HD12 ' B' ' 17' ' ' LEU . 6.8 mt -70.83 -32.93 70.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 110.259 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.34 -44.44 92.64 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.295 -0.878 . . . . 0.0 110.651 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.456 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 16.4 t -70.14 -38.11 75.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.28 -0.888 . . . . 0.0 111.151 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.952 HD12 ' HA ' ' B' ' 14' ' ' LEU . 21.6 mt -58.65 -55.66 32.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.067 -1.02 . . . . 0.0 110.334 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -45.96 -29.05 1.29 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.264 -0.897 . . . . 0.0 110.251 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.456 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 60.0 t80 -64.76 -29.5 70.48 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.968 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -68.95 -21.58 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.32 -0.863 . . . . 0.0 110.015 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.509 ' CE2' HD21 ' B' ' 51' ' ' LEU . 9.5 m-30 -66.41 -36.94 84.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.897 . . . . 0.0 110.051 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -63.38 -40.83 98.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -75.05 -1.78 24.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.189 -0.944 . . . . 0.0 109.659 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.46 ' HB3' HD12 ' B' ' 27' ' ' LEU . 84.0 m-70 -144.86 35.19 1.13 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.443 -0.786 . . . . 0.0 109.421 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.526 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.7 t -57.61 -8.7 0.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.437 -0.789 . . . . 0.0 111.045 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 66.7 p -95.78 4.54 52.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.011 -1.056 . . . . 0.0 110.392 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' B' ' 27' ' ' LEU . 8.7 mt -92.32 -49.81 5.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 0.0 110.053 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.526 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 10.4 p90 -99.45 165.71 11.52 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 8.7 m -101.46 -30.96 11.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.037 -1.04 . . . . 0.0 110.969 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.37 111.63 2.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.072 -1.018 . . . . 0.0 110.71 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.505 HG12 HD23 ' B' ' 51' ' ' LEU . 32.9 m -90.59 143.35 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 110.127 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.622 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -92.09 144.99 24.87 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.15 -0.969 . . . . 0.0 110.459 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 161.7 9.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.381 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 15.7 m -68.09 132.14 46.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.279 -0.888 . . . . 0.0 110.508 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.6 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 56.1 p-90 -146.76 -177.97 5.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.876 . . . . 0.0 109.774 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.637 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 25.0 t60 -162.38 174.48 12.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.951 -1.093 . . . . 0.0 110.548 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.637 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 39.3 m95 -78.37 100.06 6.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.402 -0.811 . . . . 0.0 109.763 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.815 . . . . 0.0 110.314 -179.667 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.502 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.39 0.614 . . . . 0.0 110.399 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.502 HG13 ' C ' ' B' ' 47' ' ' ALA . 20.0 mt -143.96 168.21 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.398 -0.814 . . . . 0.0 110.102 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 49' ' ' VAL . . . . . 0.414 HG13 ' N ' ' B' ' 50' ' ' THR . 0.3 OUTLIER -147.46 -179.8 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.11 -0.993 . . . . 0.0 110.254 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.439 ' O ' ' OG ' ' B' ' 32' ' ' SER . 89.9 m -146.41 156.76 43.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.0 109.852 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.509 HD21 ' CE2' ' B' ' 21' ' ' PHE . 1.6 mt -134.62 125.33 26.96 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.983 -1.073 . . . . 0.0 110.123 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.87 134.31 41.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.283 -0.886 . . . . 0.0 110.482 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.501 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 47.3 m-85 -120.29 155.01 34.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.289 -0.882 . . . . 0.0 110.243 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -86.39 -10.67 53.87 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.235 -0.916 . . . . 0.0 110.521 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.07 150.25 18.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 0.0 110.567 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 25.9 mt-10 -63.62 -39.14 93.62 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.254 -0.904 . . . . 0.0 109.938 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 57' ' ' TRP . . . . . 0.421 ' O ' ' HG3' ' B' ' 61' ' ' GLN . 62.2 t-105 -53.6 -52.18 60.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.226 -0.922 . . . . 0.0 109.851 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -57.3 -35.64 70.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.38 -0.825 . . . . 0.0 110.621 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 22.1 ttp85 -59.68 -50.02 75.49 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.088 -1.008 . . . . 0.0 110.956 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -60.97 -33.36 73.09 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.249 -0.907 . . . . 0.0 110.817 -179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' B' ' 57' ' ' TRP . 35.4 mt-30 -65.64 -47.32 75.98 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.085 -1.01 . . . . 0.0 110.368 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.984 ' O ' HG22 ' B' ' 66' ' ' VAL . 0.8 OUTLIER -55.67 -43.89 76.76 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 109.971 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 87.0 mt -59.28 -35.56 73.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.298 -0.877 . . . . 0.0 110.474 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.8 t -77.83 -18.65 56.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.24 -0.912 . . . . 0.0 110.315 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -94.65 -9.81 33.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.115 -0.99 . . . . 0.0 110.566 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.984 HG22 ' O ' ' B' ' 62' ' ' PHE . 27.6 m -141.89 93.28 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 120.962 -1.086 . . . . 0.0 110.565 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.531 ' O ' ' HG3' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -76.33 113.13 13.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.228 -0.92 . . . . 0.0 110.081 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.897 HG22 ' HD2' ' B' ' 69' ' ' PRO . 0.0 OUTLIER -89.56 162.63 35.92 Favored Pre-proline 0 N--CA 1.497 1.891 0 O-C-N 121.153 -0.967 . . . . 0.0 109.611 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.897 ' HD2' HG22 ' B' ' 68' ' ' ILE . 46.2 Cg_endo -60.64 -177.25 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.841 1.443 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -93.51 -5.56 48.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.17 -0.956 . . . . 0.0 110.368 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 88.0 m -84.59 -20.38 31.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.193 -0.942 . . . . 0.0 110.002 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.547 ' CG2' ' HG ' ' B' ' 7' ' ' LEU . 36.6 mt -94.67 107.46 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.333 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 88.9 m -95.33 157.28 15.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.394 -0.816 . . . . 0.0 110.881 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.732 ' CG2' HG13 ' B' ' 5' ' ' VAL . 8.2 p -141.96 130.51 22.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 CA-C-O 121.948 0.88 . . . . 0.0 111.188 -178.71 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.78 171.42 7.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.352 0.596 . . . . 0.0 110.554 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 33.4 p -110.29 145.37 37.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.322 -0.862 . . . . 0.0 109.848 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -156.12 176.48 33.55 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -147.87 147.62 29.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.241 -1.152 . . . . 0.0 110.179 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.471 ' SD ' HG21 ' B' ' 4' ' ' ILE . 24.4 mtt -120.91 177.81 4.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.298 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.9 t -140.51 107.15 5.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.917 . . . . 0.0 110.358 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.198 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.247 0.546 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.34 150.89 77.74 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 46.4 Cg_endo -100.99 145.78 0.31 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.886 1.466 . . . . 0.0 110.313 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.78 167.68 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 110.145 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.1 t -145.91 130.29 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.201 -0.937 . . . . 0.0 110.413 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.541 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.8 m170 -105.98 125.16 50.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 109.959 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 HD11 ' A' ' 51' ' ' LEU . 1.9 pp -121.92 146.77 46.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.084 -1.01 . . . . 0.0 110.478 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.611 ' O ' HD13 ' A' ' 72' ' ' ILE . 12.4 ttmm -139.35 161.96 36.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.22 -0.925 . . . . 0.0 110.483 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.45 -165.93 38.13 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -65.05 140.37 58.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -1.217 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.455 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.42 -49.81 53.76 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 110.498 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -64.54 -43.53 93.7 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.279 -0.888 . . . . 0.0 110.845 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.7 m -57.81 -24.84 59.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.127 -0.983 . . . . 0.0 110.433 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.495 HD22 HD11 ' A' ' 7' ' ' LEU . 46.6 mt -79.75 -30.94 40.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.885 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -59.49 -41.82 90.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.478 -0.764 . . . . 0.0 110.558 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.53 -37.13 76.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.301 -0.874 . . . . 0.0 110.603 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 14' ' ' LEU . 11.9 mt -59.07 -52.36 66.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.154 -0.967 . . . . 0.0 110.613 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -45.24 -31.39 1.5 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.679 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -64.82 -40.69 95.59 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.246 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -66.91 -35.92 81.08 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.1 m-30 -66.45 -35.38 80.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 110.32 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -63.43 -40.57 97.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -75.01 -37.85 61.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.0 110.318 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.632 ' O ' ' N ' ' A' ' 26' ' ' THR . 90.7 m-70 -95.44 33.75 1.55 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.163 -0.961 . . . . 0.0 110.443 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.579 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 32.0 p -59.36 53.36 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.489 -0.757 . . . . 0.0 111.275 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.632 ' N ' ' O ' ' A' ' 24' ' ' HIS . 14.8 p -144.42 34.63 1.18 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.936 -1.102 . . . . 0.0 109.853 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.7 HD23 ' HG3' ' A' ' 58' ' ' GLN . 10.4 mt -146.77 -21.69 0.42 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.194 -0.941 . . . . 0.0 111.382 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.62 ' CE2' ' CG2' ' A' ' 31' ' ' VAL . 39.8 p90 -115.42 166.64 11.66 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.442 -1.411 . . . . 0.0 109.56 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.85 -32.33 10.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.923 -1.111 . . . . 0.0 111.514 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.605 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.45 117.7 2.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.801 -1.187 . . . . 0.0 111.111 -179.442 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.62 ' CG2' ' CE2' ' A' ' 28' ' ' TYR . 5.1 t -89.84 102.16 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 110.025 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.595 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 5.0 p -69.39 147.05 51.54 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.482 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.35 161.1 9.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 110.226 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.558 ' HA ' HG22 ' A' ' 49' ' ' VAL . 3.0 t -68.28 140.79 55.99 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.383 -0.823 . . . . 0.0 110.753 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.605 ' CE3' ' HB2' ' B' ' 32' ' ' SER . 63.2 p-90 -146.95 -176.1 5.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.405 -0.809 . . . . 0.0 109.418 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 4.4 p80 -162.57 174.32 12.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.89 -1.131 . . . . 0.0 111.047 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.507 ' CE3' ' HB1' ' B' ' 30' ' ' ALA . 57.7 m95 -79.13 118.46 21.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.538 -0.726 . . . . 0.0 110.09 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.0 m . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.334 -0.854 . . . . 0.0 110.306 -179.796 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.293 0.568 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' TRP . 16.8 mt -142.74 141.85 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.297 -0.877 . . . . 0.0 109.958 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.558 HG22 ' HA ' ' A' ' 34' ' ' THR . 91.7 t -124.37 122.75 64.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.083 -1.011 . . . . 0.0 110.427 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.5 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 20.7 m -94.37 157.32 16.08 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.289 -0.882 . . . . 0.0 110.116 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.522 HD11 HD23 ' A' ' 7' ' ' LEU . 1.2 mt -135.32 130.98 35.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.254 -0.904 . . . . 0.0 110.198 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.605 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 63.4 p -96.76 127.29 42.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.237 -0.914 . . . . 0.0 110.464 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.556 ' OH ' ' CE2' ' A' ' 62' ' ' PHE . 27.4 m-85 -103.78 146.39 28.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 110.026 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 -9.68 55.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.175 -0.953 . . . . 0.0 110.769 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.9 p -162.62 134.98 5.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.068 -1.02 . . . . 0.0 110.591 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.409 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -51.93 -40.16 60.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.292 -0.88 . . . . 0.0 109.848 179.64 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 4.7 t-105 -53.55 -55.27 27.04 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.441 -0.787 . . . . 0.0 109.995 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.7 ' HG3' HD23 ' A' ' 27' ' ' LEU . 16.3 tt0 -57.03 -35.37 69.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.332 -0.855 . . . . 0.0 110.39 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.479 ' O ' ' HB3' ' A' ' 62' ' ' PHE . 7.3 ttp85 -59.52 -33.48 71.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.096 -1.003 . . . . 0.0 109.992 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -61.53 -60.8 3.14 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.359 -0.838 . . . . 0.0 111.305 -179.501 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.524 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 4.1 pm0 -65.14 -18.85 65.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.006 -1.059 . . . . 0.0 110.758 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.599 ' O ' HG22 ' A' ' 66' ' ' VAL . 38.4 t80 -57.25 -65.01 0.7 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.009 -1.057 . . . . 0.0 110.401 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.577 ' HA ' HG22 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -59.51 -39.86 85.2 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.478 -0.764 . . . . 0.0 111.312 -179.235 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.51 -22.03 66.68 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.907 -1.121 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.524 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 15.6 mm-40 -95.37 -30.54 13.86 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.344 -0.848 . . . . 0.0 109.967 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.799 ' O ' HG23 ' A' ' 66' ' ' VAL . 15.1 m -97.91 85.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.302 -0.874 . . . . 0.0 109.72 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.47 ' C ' ' O ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -38.44 105.77 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.342 -0.849 . . . . 0.0 110.441 -179.639 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.507 ' O ' HG23 ' A' ' 68' ' ' ILE . 10.9 tt -89.53 126.67 57.4 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.532 -0.73 . . . . 0.0 110.17 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.08 -177.81 1.48 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.926 1.487 . . . . 0.0 110.396 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -86.64 -12.79 47.47 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.216 -0.928 . . . . 0.0 110.226 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.74 -11.21 56.28 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 110.165 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.611 HD13 ' O ' ' A' ' 8' ' ' LYS . 9.8 mm -94.37 121.33 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.16 -0.962 . . . . 0.0 109.96 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.3 m -95.23 136.09 36.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.05 -1.031 . . . . 0.0 109.818 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.2 t -88.75 156.97 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.055 -1.028 . . . . 0.0 110.871 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.541 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 1.2 m -142.73 154.83 44.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.833 -0.542 . . . . 0.0 110.341 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.1 p -133.0 134.98 45.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.075 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.6 -175.57 30.71 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -148.1 152.78 37.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.206 -1.173 . . . . 0.0 110.528 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -123.74 169.69 11.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.334 -0.854 . . . . 0.0 109.949 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.713 ' C ' HD12 ' A' ' 81' ' ' ILE . 9.6 t -150.22 99.65 2.82 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.244 -0.91 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.713 HD12 ' C ' ' A' ' 80' ' ' SER . 1.1 mp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.051 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.306 0.574 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.2 150.45 76.54 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.25 -0.906 . . . . 0.0 110.094 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.507 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.2 Cg_endo -100.19 145.59 0.38 Allowed 'Trans proline' 0 C--N 1.304 -1.791 0 O-C-N 123.94 1.494 . . . . 0.0 110.187 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.72 168.09 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.02 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -146.12 130.35 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.93 . . . . 0.0 110.426 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.569 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.7 m170 -106.09 125.64 51.23 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.297 -0.877 . . . . 0.0 109.782 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.517 HD23 HD11 ' B' ' 51' ' ' LEU . 1.9 pp -122.76 147.26 46.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.987 -1.071 . . . . 0.0 110.536 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.625 ' O ' HD13 ' B' ' 72' ' ' ILE . 12.4 ttmm -139.61 162.03 36.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.288 -0.882 . . . . 0.0 110.465 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.84 -166.38 38.57 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -64.93 140.18 58.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -1.172 . . . . 0.0 110.252 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.453 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.97 -49.56 49.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -65.0 -43.52 92.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.828 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 75.5 m -57.64 -24.28 55.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.184 -0.948 . . . . 0.0 110.504 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.479 HD22 HD11 ' B' ' 7' ' ' LEU . 41.7 mt -80.82 -30.64 35.78 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.155 -0.966 . . . . 0.0 109.918 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -59.42 -41.91 90.6 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.406 -0.808 . . . . 0.0 110.45 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -69.78 -37.27 76.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.369 -0.832 . . . . 0.0 110.605 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 mt -58.82 -51.55 69.54 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.033 -1.042 . . . . 0.0 110.297 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.5 ttp85 -45.49 -31.69 1.88 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.291 -0.88 . . . . 0.0 110.582 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -64.78 -40.6 95.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.109 -0.994 . . . . 0.0 110.239 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -67.15 -35.76 80.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.145 -0.972 . . . . 0.0 110.156 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.427 ' N ' ' CD1' ' B' ' 21' ' ' PHE . 10.1 m-30 -66.43 -35.11 79.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -63.51 -40.87 98.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.313 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -75.02 -38.03 61.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.165 -0.96 . . . . 0.0 110.452 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.633 ' O ' ' N ' ' B' ' 26' ' ' THR . 91.3 m-70 -95.25 33.8 1.51 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.202 -0.936 . . . . 0.0 110.348 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.594 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 32.0 p -59.34 53.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.536 -0.727 . . . . 0.0 111.318 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.633 ' N ' ' O ' ' B' ' 24' ' ' HIS . 9.3 p -144.38 34.73 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.908 -1.12 . . . . 0.0 109.822 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.678 HD23 ' HG3' ' B' ' 58' ' ' GLN . 10.9 mt -146.9 -21.47 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.181 -0.949 . . . . 0.0 111.356 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.594 ' CE1' ' HA ' ' B' ' 25' ' ' CYS . 39.5 p90 -115.45 166.73 11.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.604 -1.31 . . . . 0.0 109.558 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -32.6 10.57 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.941 -1.099 . . . . 0.0 111.583 -179.13 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.598 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.58 118.07 2.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.816 -1.177 . . . . 0.0 111.08 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.593 ' CG2' ' CE2' ' B' ' 28' ' ' TYR . 4.6 t -89.91 101.08 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.361 -0.837 . . . . 0.0 110.086 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.605 ' HB2' ' CE3' ' A' ' 35' ' ' TRP . 5.5 p -67.85 146.78 53.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.075 -1.016 . . . . 0.0 110.438 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.38 161.6 9.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.221 -0.925 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.564 ' HA ' HG22 ' B' ' 49' ' ' VAL . 3.5 t -68.27 140.38 55.99 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.3 -0.875 . . . . 0.0 110.628 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.595 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 62.8 p-90 -147.03 -176.43 5.21 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.369 -0.832 . . . . 0.0 109.542 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 4.8 p80 -162.44 174.4 12.77 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.839 -1.163 . . . . 0.0 111.121 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.465 ' CE3' ' HB1' ' A' ' 30' ' ' ALA . 56.8 m95 -79.21 118.34 21.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.447 -0.783 . . . . 0.0 110.183 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 20.4 m . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.322 -0.861 . . . . 0.0 110.248 -179.928 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.307 0.575 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 35' ' ' TRP . 15.9 mt -142.61 142.05 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.415 -0.803 . . . . 0.0 109.996 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 49' ' ' VAL . . . . . 0.564 HG22 ' HA ' ' B' ' 34' ' ' THR . 88.9 t -124.47 121.91 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.069 -1.019 . . . . 0.0 110.209 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.569 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 18.1 m -93.8 157.7 16.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.933 . . . . 0.0 109.953 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.517 HD11 HD23 ' B' ' 7' ' ' LEU . 1.2 mt -135.26 131.53 36.7 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.114 -0.991 . . . . 0.0 110.266 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.598 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 56.6 p -97.06 127.52 43.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.372 -0.83 . . . . 0.0 110.51 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.52 ' OH ' ' CE2' ' B' ' 62' ' ' PHE . 28.7 m-85 -104.32 146.43 28.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.892 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.63 -8.65 57.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 110.805 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 73.1 p -163.83 135.21 4.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.067 -1.02 . . . . 0.0 110.585 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.95 -40.27 60.59 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.86 . . . . 0.0 109.961 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -53.42 -54.99 28.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.333 -0.854 . . . . 0.0 109.894 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.678 ' HG3' HD23 ' B' ' 27' ' ' LEU . 17.4 tt0 -57.02 -36.0 69.93 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.386 -0.821 . . . . 0.0 110.455 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' B' ' 62' ' ' PHE . 6.4 ttp180 -59.54 -33.17 71.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.971 -1.081 . . . . 0.0 110.128 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' B' ' 63' ' ' LEU . 0.3 OUTLIER -61.48 -60.81 3.14 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.394 -0.816 . . . . 0.0 111.205 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.526 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 4.2 pm0 -65.17 -19.14 65.83 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.902 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.612 ' O ' HG22 ' B' ' 66' ' ' VAL . 36.2 t80 -57.02 -65.35 0.63 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.055 -1.028 . . . . 0.0 110.36 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.58 ' HA ' HG22 ' B' ' 66' ' ' VAL . 0.4 OUTLIER -59.36 -39.37 83.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.452 -0.78 . . . . 0.0 111.305 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.87 -21.82 66.49 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.859 -1.151 . . . . 0.0 110.292 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 15.4 mm-40 -95.42 -30.95 13.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.896 . . . . 0.0 109.985 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.797 HG23 ' O ' ' B' ' 66' ' ' VAL . 16.6 m -97.42 85.49 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 109.895 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.466 ' C ' ' O ' ' B' ' 66' ' ' VAL . 0.1 OUTLIER -37.84 105.92 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.421 -0.8 . . . . 0.0 110.56 -179.711 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.503 ' O ' HG23 ' B' ' 68' ' ' ILE . 10.3 tt -89.89 126.7 56.62 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.359 -0.838 . . . . 0.0 110.182 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -67.93 -177.88 1.46 Allowed 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 124.018 1.536 . . . . 0.0 110.32 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -86.74 -12.85 47.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.248 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -11.58 55.42 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 110.216 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.625 HD13 ' O ' ' B' ' 8' ' ' LYS . 9.8 mm -94.3 121.41 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.217 -0.927 . . . . 0.0 109.898 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.0 m -95.41 136.35 35.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.018 -1.052 . . . . 0.0 109.937 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 11.1 t -88.55 156.92 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.029 -1.045 . . . . 0.0 111.074 -178.287 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 75' ' ' SER . . . . . 0.543 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 1.4 m -142.52 154.76 44.77 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.75 -0.594 . . . . 0.0 110.402 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.0 p -133.1 134.68 44.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.175 -0.953 . . . . 0.0 110.103 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.51 -175.62 30.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -147.88 153.01 38.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.177 -1.19 . . . . 0.0 110.509 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -124.12 168.6 12.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.272 -0.892 . . . . 0.0 110.039 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.721 ' C ' HD12 ' B' ' 81' ' ' ILE . 9.2 t -149.08 99.87 3.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.145 -0.972 . . . . 0.0 110.417 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.721 HD12 ' C ' ' B' ' 80' ' ' SER . 1.1 mp . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 118.035 -0.984 . . . . 0.0 109.969 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.455 ' HB3' ' CD2' ' A' ' 78' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.246 0.546 . . . . 0.0 110.152 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -146.39 170.89 7.13 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.212 -0.93 . . . . 0.0 110.303 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 51.9 Cg_endo -104.61 145.6 0.13 Allowed 'Trans proline' 0 C--N 1.307 -1.638 0 O-C-N 124.034 1.544 . . . . 0.0 110.308 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.511 HD11 ' SD ' ' B' ' 79' ' ' MET . 2.8 pt -143.82 162.63 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.212 -0.93 . . . . 0.0 110.041 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.534 HG23 HG22 ' A' ' 74' ' ' VAL . 9.6 p -145.78 127.47 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 0.0 110.074 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.613 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.1 m170 -104.13 118.32 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.348 -0.845 . . . . 0.0 110.135 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.626 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.3 pp -111.54 150.91 29.31 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.127 -0.983 . . . . 0.0 110.222 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.517 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 7.6 tptm -138.71 159.27 42.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 110.482 -179.132 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.517 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 170.67 -174.56 44.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.482 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 40.2 m-20 -65.05 141.49 58.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.153 -1.204 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.33 -69.28 0.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.238 -0.914 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -47.78 -44.96 28.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.065 -1.022 . . . . 0.0 110.385 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.482 ' HB ' ' HB2' ' A' ' 10' ' ' ASP . 41.4 m -58.22 -22.81 53.55 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.257 -0.902 . . . . 0.0 110.61 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 62.8 mt -78.39 -29.79 47.46 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.179 -0.951 . . . . 0.0 110.532 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -59.71 -34.44 72.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.211 -0.931 . . . . 0.0 110.417 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.504 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.9 t -70.27 -46.13 64.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.358 -0.839 . . . . 0.0 110.943 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.8 mp -58.82 -52.76 64.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.057 -1.027 . . . . 0.0 110.59 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.413 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 10.5 ttm180 -45.04 -24.69 0.25 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.221 -0.924 . . . . 0.0 110.516 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.504 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 40.1 t80 -64.8 -40.46 95.26 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.078 -1.014 . . . . 0.0 110.234 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -72.88 -21.18 60.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 110.134 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 8.6 m-30 -66.26 -31.32 72.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 109.954 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -63.57 -33.98 76.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.338 -0.851 . . . . 0.0 110.336 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -75.08 -35.15 61.82 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.245 -0.909 . . . . 0.0 110.41 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.643 ' HB3' HD12 ' A' ' 27' ' ' LEU . 73.4 m-70 -94.48 40.93 1.09 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.243 -0.91 . . . . 0.0 110.12 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.581 ' SG ' HG23 ' A' ' 26' ' ' THR . 27.3 p -57.65 -21.52 40.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.355 -0.841 . . . . 0.0 110.512 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.581 HG23 ' SG ' ' A' ' 25' ' ' CYS . 69.2 p -96.52 10.91 36.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.095 -1.003 . . . . 0.0 110.499 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.643 HD12 ' HB3' ' A' ' 24' ' ' HIS . 2.3 mt -92.26 -49.39 6.2 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 110.16 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.467 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 4.4 p90 -98.9 168.56 10.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.247 -0.908 . . . . 0.0 110.236 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.1 m -98.92 -31.35 11.87 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.848 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.08 116.09 2.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.011 -1.056 . . . . 0.0 110.608 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.409 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.2 p -90.2 135.06 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.883 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.486 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -108.37 154.25 22.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.083 -1.011 . . . . 0.0 110.689 -179.689 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.35 162.56 7.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.359 -0.838 . . . . 0.0 110.265 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.2 t -68.14 131.06 44.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.26 -0.9 . . . . 0.0 110.751 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.556 ' HB3' ' CB ' ' B' ' 35' ' ' TRP . 3.9 p-90 -146.93 157.51 43.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.353 -0.842 . . . . 0.0 109.405 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -162.58 -173.73 3.67 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.823 -1.173 . . . . 0.0 111.354 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.6 m95 -79.97 138.82 37.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.66 -0.65 . . . . 0.0 110.114 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 110.408 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.413 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.322 0.582 . . . . 0.0 109.968 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.626 HG23 ' O ' ' A' ' 7' ' ' LEU . 74.1 mt -145.03 133.76 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.326 -0.859 . . . . 0.0 110.123 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.423 ' O ' ' CD2' ' A' ' 7' ' ' LEU . 19.1 t -119.73 130.27 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.049 -1.032 . . . . 0.0 110.442 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.58 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 3.0 m -94.16 156.41 16.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.336 -0.853 . . . . 0.0 110.234 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.498 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 1.0 OUTLIER -135.01 129.98 34.97 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.245 -0.909 . . . . 0.0 109.637 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.11 130.94 44.32 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.217 -0.927 . . . . 0.0 110.675 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HG2' ' A' ' 3' ' ' PRO . 49.0 m-85 -118.48 155.79 30.21 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.383 -0.823 . . . . 0.0 109.956 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.69 -10.32 59.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 110.32 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.9 p -170.26 166.19 8.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.168 -0.958 . . . . 0.0 110.305 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.44 -34.96 73.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.344 -0.848 . . . . 0.0 110.171 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -53.79 -50.82 65.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.342 -0.848 . . . . 0.0 110.12 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -57.95 -38.04 75.25 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.251 -0.906 . . . . 0.0 110.855 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.582 ' HE ' HD11 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -59.18 -44.31 92.17 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.003 -1.06 . . . . 0.0 110.745 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.441 ' HA ' HD12 ' A' ' 63' ' ' LEU . 46.7 t0 -61.01 -38.58 86.6 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.104 -0.998 . . . . 0.0 110.518 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -65.92 -41.49 91.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.134 -0.979 . . . . 0.0 110.725 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.897 ' O ' HG22 ' A' ' 66' ' ' VAL . 2.7 t80 -55.85 -47.4 77.35 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.582 HD11 ' HE ' ' A' ' 59' ' ' ARG . 13.5 mt -59.44 -44.66 92.9 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.256 -0.903 . . . . 0.0 110.459 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -21.45 66.54 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.254 -0.904 . . . . 0.0 110.63 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -95.44 -25.26 16.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.085 -1.01 . . . . 0.0 110.369 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.897 HG22 ' O ' ' A' ' 62' ' ' PHE . 31.2 m -103.64 105.06 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.892 . . . . 0.0 110.036 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -51.4 97.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.192 -0.943 . . . . 0.0 110.395 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.618 ' O ' HG23 ' A' ' 68' ' ' ILE . 9.4 tp -88.66 117.5 68.39 Favored Pre-proline 0 N--CA 1.487 1.424 0 O-C-N 121.169 -0.957 . . . . 0.0 109.979 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.689 ' CG ' HD12 ' A' ' 72' ' ' ILE . 46.2 Cg_endo -60.58 167.97 7.45 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.916 1.482 . . . . 0.0 110.852 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -79.53 -12.98 59.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.45 -0.782 . . . . 0.0 110.315 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.61 -23.73 29.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.27 -0.894 . . . . 0.0 110.227 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.689 HD12 ' CG ' ' A' ' 69' ' ' PRO . 66.0 mt -93.68 115.27 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.913 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.3 m -95.09 142.48 27.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.323 -0.861 . . . . 0.0 110.727 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.616 HG22 ' H ' ' A' ' 75' ' ' SER . 6.0 p -92.25 178.49 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.421 -0.799 . . . . 0.0 110.582 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.616 ' H ' HG22 ' A' ' 74' ' ' VAL . 0.6 OUTLIER -143.85 158.76 43.47 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.499 179.216 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.6 p -133.86 135.12 43.5 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.231 -0.918 . . . . 0.0 110.058 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -160.74 177.03 37.31 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.455 ' CD2' ' HB3' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.93 120.43 8.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.287 -1.125 . . . . 0.0 109.969 -179.802 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.518 ' SD ' HD11 ' B' ' 4' ' ' ILE . 18.3 mmm -95.13 171.74 8.55 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.051 -1.031 . . . . 0.0 110.576 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.422 ' O ' HG23 ' A' ' 81' ' ' ILE . 86.3 p -153.67 107.81 3.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.33 -0.856 . . . . 0.0 110.305 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.422 HG23 ' O ' ' A' ' 80' ' ' SER . 4.6 pt . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.225 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.487 ' CG ' ' O ' ' B' ' 79' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.198 0.523 . . . . 0.0 110.11 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.5 t -146.13 171.96 5.84 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.262 -0.899 . . . . 0.0 110.103 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.499 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 51.1 Cg_endo -106.13 145.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.847 1.446 . . . . 0.0 110.054 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.518 HD11 ' SD ' ' A' ' 79' ' ' MET . 2.7 pt -143.83 162.79 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.253 -0.904 . . . . 0.0 110.04 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.562 HG23 HG22 ' B' ' 74' ' ' VAL . 8.6 p -145.67 127.84 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.336 -0.853 . . . . 0.0 110.08 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.614 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 1.5 m170 -104.66 118.19 35.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.355 -0.841 . . . . 0.0 110.148 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.649 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.3 pp -111.35 150.93 29.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 110.219 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.522 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 7.7 tptm -138.56 159.53 41.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 110.381 -179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.522 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 170.23 -174.55 44.3 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 10' ' ' ASP . . . . . 0.485 ' HB2' ' HB ' ' B' ' 13' ' ' THR . 40.6 m-20 -65.12 141.83 58.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.126 -1.22 . . . . 0.0 110.291 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.37 -69.4 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.315 -0.865 . . . . 0.0 110.524 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -47.54 -45.49 26.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.156 -0.965 . . . . 0.0 110.528 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.485 ' HB ' ' HB2' ' B' ' 10' ' ' ASP . 37.2 m -58.14 -22.09 49.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 110.723 -179.677 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 65.2 mt -78.83 -29.69 44.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.141 -0.975 . . . . 0.0 110.487 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -59.82 -34.4 73.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.213 -0.929 . . . . 0.0 110.319 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.506 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 1.6 t -70.31 -46.49 64.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.215 -0.928 . . . . 0.0 110.966 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.64 -52.81 64.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.066 -1.021 . . . . 0.0 110.536 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -45.09 -24.74 0.26 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 110.621 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 41.5 t80 -64.8 -39.7 94.02 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.216 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -73.41 -21.29 60.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.145 -0.972 . . . . 0.0 110.159 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -66.18 -31.43 72.26 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.228 -0.92 . . . . 0.0 109.897 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -63.49 -33.76 76.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.12 -35.16 61.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.175 -0.953 . . . . 0.0 110.436 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.643 ' HB3' HD12 ' B' ' 27' ' ' LEU . 76.0 m-70 -94.84 41.16 1.09 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.942 . . . . 0.0 110.169 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.605 ' SG ' HG23 ' B' ' 26' ' ' THR . 27.5 p -57.32 -21.07 32.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.359 -0.838 . . . . 0.0 110.379 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.605 HG23 ' SG ' ' B' ' 25' ' ' CYS . 69.8 p -96.91 10.63 38.51 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.128 -0.982 . . . . 0.0 110.467 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.643 HD12 ' HB3' ' B' ' 24' ' ' HIS . 2.6 mt -92.23 -49.18 6.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.19 -0.944 . . . . 0.0 110.286 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.478 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 4.3 p90 -98.92 168.45 10.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.5 m -98.78 -31.12 12.04 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.25 -0.906 . . . . 0.0 110.68 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.29 116.44 2.7 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.011 -1.056 . . . . 0.0 110.594 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.411 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.2 p -90.27 135.14 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.304 -0.873 . . . . 0.0 109.663 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.478 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -108.2 154.66 21.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.114 -0.991 . . . . 0.0 110.615 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.39 162.44 7.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.43 -0.794 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 2.1 t -68.24 130.51 43.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.266 -0.896 . . . . 0.0 110.64 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.556 ' CB ' ' HB3' ' A' ' 35' ' ' TRP . 4.3 p-90 -146.83 157.33 43.63 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.287 -0.883 . . . . 0.0 109.368 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -162.45 -173.68 3.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.866 -1.146 . . . . 0.0 111.359 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -79.89 139.94 36.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.686 -0.634 . . . . 0.0 109.995 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.625 0 O-C-N 121.199 -0.938 . . . . 0.0 110.322 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.334 0.588 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.649 HG23 ' O ' ' B' ' 7' ' ' LEU . 74.7 mt -144.98 133.32 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 109.967 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 49' ' ' VAL . . . . . 0.422 ' O ' ' CD2' ' B' ' 7' ' ' LEU . 16.5 t -119.2 130.37 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.038 -1.039 . . . . 0.0 110.424 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.587 HG23 ' CD2' ' B' ' 6' ' ' HIS . 2.7 m -94.07 157.1 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.308 -0.87 . . . . 0.0 110.27 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.495 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 1.0 OUTLIER -135.51 129.84 33.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 179.614 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.13 131.01 44.31 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.154 -0.966 . . . . 0.0 110.711 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 44.0 m-85 -118.65 155.44 31.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 0.0 110.085 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -70.8 -10.1 58.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.156 -0.965 . . . . 0.0 110.488 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 40.7 p -170.1 166.17 9.13 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.209 -0.932 . . . . 0.0 110.269 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -70.59 -35.1 72.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.182 -0.948 . . . . 0.0 110.236 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.47 -51.04 64.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.403 -0.811 . . . . 0.0 110.224 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -58.02 -37.18 73.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 110.734 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.58 ' HE ' HD11 ' B' ' 63' ' ' LEU . 0.2 OUTLIER -59.55 -44.71 93.18 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.085 -1.01 . . . . 0.0 110.631 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.432 ' HA ' HD12 ' B' ' 63' ' ' LEU . 48.0 t0 -60.94 -38.41 85.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.197 -0.94 . . . . 0.0 110.624 -179.45 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -65.8 -41.44 91.93 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.268 -0.895 . . . . 0.0 110.747 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.912 ' O ' HG22 ' B' ' 66' ' ' VAL . 2.3 t80 -55.96 -47.41 77.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.156 -0.965 . . . . 0.0 110.24 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.58 HD11 ' HE ' ' B' ' 59' ' ' ARG . 13.7 mt -59.48 -43.95 93.14 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.166 -0.959 . . . . 0.0 110.652 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -21.33 66.23 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.204 -0.935 . . . . 0.0 110.628 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.31 -25.27 16.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.157 -0.964 . . . . 0.0 110.296 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.912 HG22 ' O ' ' B' ' 62' ' ' PHE . 32.4 m -103.78 104.81 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.3 -0.875 . . . . 0.0 109.952 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttt -51.34 97.59 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.319 -0.863 . . . . 0.0 110.379 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.595 ' O ' HG23 ' B' ' 68' ' ' ILE . 8.6 tp -88.43 117.77 68.73 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.259 -0.9 . . . . 0.0 109.932 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.713 ' CG ' HD12 ' B' ' 72' ' ' ILE . 48.7 Cg_endo -61.23 168.25 8.03 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.889 1.468 . . . . 0.0 110.594 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -79.98 -12.81 59.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.283 -0.886 . . . . 0.0 110.347 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.53 -23.08 29.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.224 -0.923 . . . . 0.0 110.09 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.713 HD12 ' CG ' ' B' ' 69' ' ' PRO . 67.5 mt -94.21 115.29 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.253 -0.905 . . . . 0.0 110.026 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 7.7 m -95.23 142.38 27.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.33 -0.856 . . . . 0.0 110.839 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.608 HG22 ' H ' ' B' ' 75' ' ' SER . 5.4 p -92.28 178.65 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.278 -0.889 . . . . 0.0 110.52 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 75' ' ' SER . . . . . 0.614 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -144.03 158.64 43.58 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.397 -0.814 . . . . 0.0 110.622 179.125 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.9 p -133.57 134.72 43.67 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 110.129 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.94 176.83 36.62 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.427 ' CD2' ' HB3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -148.06 119.94 8.16 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.316 -1.108 . . . . 0.0 109.82 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.511 ' SD ' HD11 ' A' ' 4' ' ' ILE . 19.1 mmm -94.52 173.08 7.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.971 -1.081 . . . . 0.0 110.472 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.421 ' O ' HG23 ' B' ' 81' ' ' ILE . 85.9 p -154.85 107.16 2.73 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.222 -0.924 . . . . 0.0 110.272 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.421 HG23 ' O ' ' B' ' 80' ' ' SER . 4.8 pt . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 117.921 -1.038 . . . . 0.0 110.262 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.205 0.526 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.5 m -68.61 121.65 81.77 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 121.263 -0.898 . . . . 0.0 110.122 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.512 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 47.1 Cg_endo -69.11 157.17 62.68 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.08 1.568 . . . . 0.0 110.52 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.605 HD11 ' HG2' ' B' ' 79' ' ' MET . 5.1 pt -143.02 169.13 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.231 -0.918 . . . . 0.0 110.031 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.575 ' CG1' HG21 ' A' ' 74' ' ' VAL . 6.4 t -145.8 125.64 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.211 -0.931 . . . . 0.0 110.187 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.47 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -106.19 119.02 38.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.347 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.738 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.4 mp -116.5 147.4 41.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.312 -0.867 . . . . 0.0 110.177 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 1.074 ' O ' HD12 ' A' ' 72' ' ' ILE . 11.5 tttt -142.42 168.5 19.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.214 -0.929 . . . . 0.0 110.388 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.432 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 151.76 -166.02 30.73 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 131.01 45.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.194 -1.18 . . . . 0.0 110.253 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.97 -39.8 41.98 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.28 -0.887 . . . . 0.0 110.726 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -66.08 -46.91 76.02 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.077 -1.015 . . . . 0.0 110.605 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 5.8 m -58.1 -27.77 64.0 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.938 . . . . 0.0 110.367 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.702 HD21 HD13 ' A' ' 72' ' ' ILE . 77.7 mt -77.71 -27.4 50.65 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.969 . . . . 0.0 110.34 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.2 ttmt -59.35 -39.39 83.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.252 -0.905 . . . . 0.0 110.411 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.2 t -70.19 -34.23 72.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.098 -1.001 . . . . 0.0 110.423 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 13' ' ' THR . 5.9 mp -58.94 -51.91 68.01 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.212 -0.93 . . . . 0.0 110.558 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.509 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 1.2 ttp-105 -46.22 -31.86 2.7 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.264 -0.897 . . . . 0.0 110.124 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.49 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 48.4 t80 -65.14 -33.06 75.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.306 -0.871 . . . . 0.0 110.391 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 -74.74 -30.32 61.46 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.203 -0.936 . . . . 0.0 110.465 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.509 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 11.1 m-30 -66.32 -21.58 66.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -63.38 -36.53 84.02 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.615 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -75.1 -40.95 59.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -0.936 . . . . 0.0 110.463 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.626 ' HB3' HD12 ' A' ' 27' ' ' LEU . 15.0 m-70 -95.12 36.52 1.21 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.227 -0.921 . . . . 0.0 110.328 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.607 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 32.0 p -57.44 -17.92 15.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.474 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.95 -3.29 41.99 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.206 -0.934 . . . . 0.0 110.518 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.626 HD12 ' HB3' ' A' ' 24' ' ' HIS . 11.2 mt -92.42 -6.19 50.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.181 -0.949 . . . . 0.0 110.495 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.607 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 22.7 p90 -144.58 -178.08 5.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.194 -0.941 . . . . 0.0 109.528 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 45.6 m -96.47 -68.99 0.77 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.914 -1.116 . . . . 0.0 110.584 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.2 20.79 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.081 -1.012 . . . . 0.0 109.012 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 31' ' ' VAL . 12.7 p -91.29 112.58 25.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 O-C-N 121.681 -0.637 . . . . 0.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.442 ' OG ' ' HB ' ' A' ' 50' ' ' THR . 79.5 p -52.59 152.62 3.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.926 -1.109 . . . . 0.0 109.373 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.417 ' OG ' ' HB2' ' B' ' 35' ' ' TRP . 0.8 OUTLIER -60.93 155.08 20.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.166 -0.959 . . . . 0.0 110.305 -179.651 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -67.64 129.78 40.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.333 -0.855 . . . . 0.0 110.318 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.483 ' HB2' ' OG ' ' B' ' 33' ' ' SER . 44.4 p-90 -146.15 176.15 9.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.189 -0.944 . . . . 0.0 109.921 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.486 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . 53.2 t-80 -162.57 177.83 9.09 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 110.351 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.471 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 80.2 m95 -78.51 123.99 27.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.225 -0.922 . . . . 0.0 110.126 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.37 -0.831 . . . . 0.0 109.916 -179.799 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.487 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.233 0.539 . . . . 0.0 110.068 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.738 HG23 ' O ' ' A' ' 7' ' ' LEU . 70.3 mt -142.07 144.56 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 110.353 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.535 HG12 ' N ' ' A' ' 50' ' ' THR . 67.5 t -116.79 169.07 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.285 -0.884 . . . . 0.0 110.458 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.535 ' N ' HG12 ' A' ' 49' ' ' VAL . 17.4 m -146.05 152.16 38.89 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.369 -0.832 . . . . 0.0 109.891 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.42 128.78 32.17 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.169 -0.957 . . . . 0.0 110.249 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.47 ' OG1' ' CZ3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.61 40.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.361 -0.837 . . . . 0.0 110.158 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.541 ' CD2' ' HA ' ' A' ' 59' ' ' ARG . 40.2 m-85 -111.91 147.35 36.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.203 -0.936 . . . . 0.0 109.93 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -93.21 -3.28 54.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 110.941 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.1 p -157.66 121.04 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.028 -1.045 . . . . 0.0 110.328 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.485 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 2.3 mt-10 -46.32 -42.44 14.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.867 . . . . 0.0 110.132 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 16.0 t-105 -53.66 -56.0 21.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -59.07 -31.21 68.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.291 -0.881 . . . . 0.0 110.629 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.541 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -59.34 -54.55 45.43 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.273 -0.892 . . . . 0.0 111.061 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.0 -31.7 71.3 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.153 -0.967 . . . . 0.0 110.975 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.432 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 36.2 mt-30 -65.64 -46.48 79.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.115 -0.991 . . . . 0.0 110.761 -179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.713 ' O ' HG12 ' A' ' 66' ' ' VAL . 38.4 t80 -56.46 -67.49 0.3 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 111.007 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.606 HD12 ' C ' ' A' ' 63' ' ' LEU . 4.2 pp -59.17 -12.98 5.93 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.227 -0.921 . . . . 0.0 110.98 -179.134 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 t -88.59 -23.41 23.12 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.036 -1.04 . . . . 0.0 109.97 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 3.6 mm100 -97.67 -44.34 6.81 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.461 -0.774 . . . . 0.0 109.829 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 62' ' ' PHE . 1.8 p -98.45 91.67 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 109.935 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.451 ' C ' HG12 ' A' ' 68' ' ' ILE . 19.1 pttp -65.29 -177.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.44 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.952 HG22 ' HD2' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -151.09 149.92 26.12 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.286 -0.884 . . . . 0.0 109.52 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.952 ' HD2' HG22 ' A' ' 68' ' ' ILE . 44.8 Cg_endo -49.7 -177.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.807 1.425 . . . . 0.0 110.455 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.74 -3.42 42.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.294 -0.879 . . . . 0.0 110.683 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -23.15 29.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.096 -1.002 . . . . 0.0 109.934 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 1.074 HD12 ' O ' ' A' ' 8' ' ' LYS . 2.2 tp -94.58 106.34 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.393 -0.817 . . . . 0.0 110.212 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.5 m -97.34 156.37 16.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.049 -1.032 . . . . 0.0 109.483 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.575 HG21 ' CG1' ' A' ' 5' ' ' VAL . 5.8 p -143.85 138.1 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 118.883 -1.127 . . . . 0.0 111.774 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 -179.22 3.94 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.899 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.6 p -128.33 155.67 44.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.214 -0.929 . . . . 0.0 110.124 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.34 -178.31 41.09 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -147.5 133.34 19.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.396 -1.061 . . . . 0.0 109.909 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.628 ' HG2' HD11 ' B' ' 4' ' ' ILE . 5.0 mtm -118.66 -179.91 3.94 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.242 -0.911 . . . . 0.0 110.55 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' B' ' 76' ' ' THR . 21.6 p -142.41 110.15 5.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.307 -0.871 . . . . 0.0 109.973 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.1 tt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.301 -179.767 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.157 0.503 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.3 m -70.47 121.78 84.51 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.3 Cg_endo -68.84 156.63 64.78 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 124.149 1.605 . . . . 0.0 110.512 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.628 HD11 ' HG2' ' A' ' 79' ' ' MET . 5.1 pt -142.5 168.9 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.349 -0.844 . . . . 0.0 109.887 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.617 HG12 HG21 ' B' ' 74' ' ' VAL . 5.3 t -145.76 124.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.206 -0.934 . . . . 0.0 110.269 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.494 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.64 119.17 38.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.215 -0.928 . . . . 0.0 110.341 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.73 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.3 mp -116.56 147.32 41.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.3 -0.875 . . . . 0.0 110.198 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 1.061 ' O ' HD12 ' B' ' 72' ' ' ILE . 11.6 tttt -142.4 168.71 19.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 110.439 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.434 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 151.61 -165.96 30.65 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 10' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 130.84 44.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -1.124 . . . . 0.0 110.196 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.28 -38.79 42.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.868 . . . . 0.0 110.67 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -66.56 -47.1 73.86 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.185 -0.947 . . . . 0.0 110.515 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.478 ' O ' HD13 ' B' ' 17' ' ' LEU . 7.1 m -58.01 -28.32 64.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.21 -0.931 . . . . 0.0 110.539 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.675 HD21 HD13 ' B' ' 72' ' ' ILE . 77.3 mt -77.37 -26.95 52.37 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 0.0 110.358 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -59.36 -39.67 84.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.194 -0.941 . . . . 0.0 110.343 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.487 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 0.8 OUTLIER -70.2 -34.22 72.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.216 -0.927 . . . . 0.0 110.367 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' B' ' 13' ' ' THR . 6.1 mp -58.8 -51.66 69.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.131 -0.98 . . . . 0.0 110.466 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.487 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 1.3 ttp-105 -46.16 -32.36 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.92 . . . . 0.0 110.098 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.487 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 48.8 t80 -64.91 -33.25 75.56 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -74.53 -30.19 61.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.264 -0.897 . . . . 0.0 110.503 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 11.3 m-30 -66.51 -21.58 66.17 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.208 -0.932 . . . . 0.0 110.459 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -63.5 -36.24 83.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.255 -0.903 . . . . 0.0 110.592 -179.744 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -75.12 -40.94 59.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.218 -0.926 . . . . 0.0 110.411 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.621 ' HB3' HD12 ' B' ' 27' ' ' LEU . 15.8 m-70 -95.07 36.28 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.464 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.593 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 31.8 p -57.38 -17.84 14.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.133 -0.98 . . . . 0.0 110.485 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.92 -3.28 42.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.111 -0.993 . . . . 0.0 110.396 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.621 HD12 ' HB3' ' B' ' 24' ' ' HIS . 10.9 mt -92.32 -6.22 50.69 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.556 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.593 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 20.7 p90 -145.04 -178.09 5.87 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.202 -0.936 . . . . 0.0 109.635 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 48.0 m -96.44 -69.19 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.91 -1.119 . . . . 0.0 110.589 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.46 20.99 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.955 -1.091 . . . . 0.0 109.065 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.678 ' O ' HG13 ' B' ' 31' ' ' VAL . 14.3 p -91.37 113.32 26.75 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.938 0 O-C-N 121.712 -0.617 . . . . 0.0 110.39 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.443 ' OG ' ' HB ' ' B' ' 50' ' ' THR . 70.7 p -53.08 152.55 4.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.006 -1.059 . . . . 0.0 109.56 179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 33' ' ' SER . . . . . 0.483 ' OG ' ' HB2' ' A' ' 35' ' ' TRP . 0.9 OUTLIER -60.77 154.45 21.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.014 -1.054 . . . . 0.0 109.98 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -67.63 130.23 42.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.161 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.453 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 44.1 p-90 -146.09 176.04 10.02 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.313 -0.867 . . . . 0.0 109.929 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' B' ' 47' ' ' ALA . 53.7 t-80 -162.55 178.05 8.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.427 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.476 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 79.6 m95 -78.5 123.78 27.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.276 -0.89 . . . . 0.0 110.067 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.32 -0.863 . . . . 0.0 109.869 -179.868 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.485 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.311 0.577 . . . . 0.0 110.008 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.73 HG23 ' O ' ' B' ' 7' ' ' LEU . 70.2 mt -142.12 144.29 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.18 -0.95 . . . . 0.0 110.318 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 49' ' ' VAL . . . . . 0.542 HG12 ' N ' ' B' ' 50' ' ' THR . 70.8 t -116.65 169.16 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 0.0 110.498 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.542 ' N ' HG12 ' B' ' 49' ' ' VAL . 17.2 m -146.04 152.96 40.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.295 -0.878 . . . . 0.0 109.804 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -136.01 128.47 30.43 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.132 -0.98 . . . . 0.0 110.232 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.417 ' OG1' ' CZ3' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.93 39.92 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.208 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.541 ' CD2' ' HA ' ' B' ' 59' ' ' ARG . 38.3 m-85 -112.31 147.69 35.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.264 -0.898 . . . . 0.0 110.034 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -93.45 -3.18 53.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.822 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' SER . . . . . 0.413 ' OG ' ' HB2' ' B' ' 58' ' ' GLN . 98.8 p -157.44 121.38 4.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.015 -1.053 . . . . 0.0 110.372 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.479 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 2.3 mt-10 -46.99 -42.18 17.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.314 -0.867 . . . . 0.0 109.978 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 16.1 t-105 -53.94 -55.83 23.38 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.413 ' HB2' ' OG ' ' B' ' 55' ' ' SER . 17.1 tt0 -59.23 -31.06 68.71 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.408 -0.807 . . . . 0.0 110.52 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.541 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 0.0 OUTLIER -59.41 -54.7 43.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.18 -0.95 . . . . 0.0 110.96 -179.645 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 60' ' ' ASP . . . . . 0.418 ' O ' ' CB ' ' B' ' 64' ' ' SER . 19.6 t70 -61.12 -31.3 71.01 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.174 -0.954 . . . . 0.0 110.893 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.442 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 36.1 mt-30 -65.76 -46.55 78.39 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.116 -0.99 . . . . 0.0 110.668 -179.59 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.705 ' O ' HG12 ' B' ' 66' ' ' VAL . 41.5 t80 -56.43 -67.84 0.27 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.242 -0.911 . . . . 0.0 111.04 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.615 ' C ' HD12 ' B' ' 63' ' ' LEU . 4.1 pp -59.14 -12.93 5.78 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.306 -0.872 . . . . 0.0 110.792 -179.094 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 11.2 t -88.46 -23.36 23.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.172 -0.955 . . . . 0.0 109.901 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 65' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 3.5 mm-40 -98.2 -44.63 6.51 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.444 -0.785 . . . . 0.0 110.02 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.705 HG12 ' O ' ' B' ' 62' ' ' PHE . 1.9 p -98.12 90.9 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.359 -0.838 . . . . 0.0 110.008 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.456 ' C ' HG12 ' B' ' 68' ' ' ILE . 19.0 pttp -64.48 -176.88 0.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.413 -0.804 . . . . 0.0 110.48 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.919 HG22 ' HD2' ' B' ' 69' ' ' PRO . 0.1 OUTLIER -151.44 149.93 25.55 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.405 -0.809 . . . . 0.0 109.682 -179.847 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.919 ' HD2' HG22 ' B' ' 68' ' ' ILE . 45.3 Cg_endo -49.35 -178.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.779 1.41 . . . . 0.0 110.655 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -4.0 43.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.288 -0.882 . . . . 0.0 110.581 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.63 -23.29 29.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.151 -0.968 . . . . 0.0 110.078 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 1.061 HD12 ' O ' ' B' ' 8' ' ' LYS . 1.9 tp -94.47 106.59 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 110.112 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 26.8 m -97.35 156.06 16.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.044 -1.035 . . . . 0.0 109.408 179.021 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.617 HG21 HG12 ' B' ' 5' ' ' VAL . 6.0 p -143.91 138.39 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.85 -1.14 . . . . 0.0 111.63 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -179.37 3.98 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.009 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 76' ' ' THR . . . . . 0.436 ' O ' ' OG ' ' A' ' 80' ' ' SER . 5.5 p -128.19 155.46 44.47 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.01 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.72 -178.32 41.31 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -147.5 133.52 19.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.336 -1.097 . . . . 0.0 110.05 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.605 ' HG2' HD11 ' A' ' 4' ' ' ILE . 5.0 mtm -118.81 179.74 4.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.341 -0.85 . . . . 0.0 110.323 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 21.6 p -142.07 110.17 5.91 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.379 -0.825 . . . . 0.0 109.88 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.402 HG22 ' H ' ' B' ' 81' ' ' ILE . 13.8 tt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.384 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.4 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.222 0.534 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.43 142.65 89.51 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.262 -0.899 . . . . 0.0 110.107 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.46 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 45.3 Cg_endo -92.5 137.22 1.6 Allowed 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.97 1.511 . . . . 0.0 110.227 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.527 HG21 ' SD ' ' A' ' 79' ' ' MET . 1.0 OUTLIER -142.8 176.05 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.861 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.557 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 12.4 p -146.11 153.69 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.199 -0.938 . . . . 0.0 110.466 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.502 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.1 OUTLIER -133.75 108.89 8.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.481 -0.762 . . . . 0.0 109.765 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.656 ' O ' HG23 ' A' ' 48' ' ' ILE . 2.4 pp -120.89 162.44 19.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.685 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.598 ' O ' HG23 ' A' ' 72' ' ' ILE . 31.3 pttt -139.58 166.4 24.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.317 -0.864 . . . . 0.0 110.22 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 167.11 178.72 39.65 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -65.34 136.4 56.48 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.304 -1.116 . . . . 0.0 110.508 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.08 -24.43 2.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.232 -0.917 . . . . 0.0 110.18 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -81.37 -51.38 8.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -57.86 -16.73 12.76 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.286 -0.883 . . . . 0.0 109.905 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 mt -90.89 -28.98 17.77 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -0.838 . . . . 0.0 110.135 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -60.19 -48.83 80.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.277 -0.889 . . . . 0.0 110.675 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.2 t -70.02 -34.91 73.89 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 110.763 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.73 -48.1 82.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.148 -0.97 . . . . 0.0 110.56 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.548 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 72.0 ttt-85 -47.69 -32.51 5.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.648 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -64.12 -25.81 68.26 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.945 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -73.68 -32.93 64.21 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.206 -0.934 . . . . 0.0 109.631 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.57 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 7.2 m-30 -66.72 -8.19 26.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.37 -0.831 . . . . 0.0 110.191 179.643 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.7 mmtt -63.06 -49.82 73.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.157 -0.965 . . . . 0.0 109.856 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -75.29 -25.93 58.33 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.248 -0.907 . . . . 0.0 109.772 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.472 ' HA ' HD13 ' A' ' 27' ' ' LEU . 18.1 m170 -95.27 29.61 2.45 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.377 -0.827 . . . . 0.0 110.018 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 p -57.26 -19.59 22.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.111 -0.993 . . . . 0.0 110.177 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.7 t -97.09 9.32 42.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 24' ' ' HIS . 4.2 mp -92.38 -33.07 14.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.123 -0.986 . . . . 0.0 110.628 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.5 p90 -118.76 168.88 10.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.964 -1.085 . . . . 0.0 110.255 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.67 -31.59 11.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.571 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.77 116.23 2.52 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.152 -0.967 . . . . 0.0 110.582 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.767 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.3 p -90.11 101.57 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.157 -0.964 . . . . 0.0 110.268 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.609 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 54.9 p -50.41 153.02 1.67 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.135 -0.978 . . . . 0.0 110.484 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.477 ' OG ' ' HB2' ' B' ' 35' ' ' TRP . 91.5 p -61.27 -96.43 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.274 -0.891 . . . . 0.0 110.506 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.471 ' N ' ' OG ' ' A' ' 33' ' ' SER . 3.2 m -171.55 125.19 0.6 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.414 -0.804 . . . . 0.0 110.036 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.56 ' CE3' ' HB2' ' B' ' 32' ' ' SER . 33.6 p-90 -147.09 -168.61 3.09 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.374 -0.829 . . . . 0.0 110.053 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.532 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . 82.6 t60 -162.64 171.14 17.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.26 -0.9 . . . . 0.0 110.183 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.505 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 4.4 m95 -79.85 99.11 7.37 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.15 -0.969 . . . . 0.0 110.054 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.478 ' O ' HG13 ' B' ' 31' ' ' VAL . 2.3 m . . . . . 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 110.013 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.539 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.188 0.518 . . . . 0.0 110.168 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.656 HG23 ' O ' ' A' ' 7' ' ' LEU . 64.4 mt -142.42 162.13 18.92 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.177 -0.952 . . . . 0.0 110.102 -179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.6 t -135.95 167.98 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.702 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.496 ' OG1' ' CE1' ' A' ' 6' ' ' HIS . 82.9 m -145.99 153.81 41.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.603 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.557 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 0.5 OUTLIER -136.33 136.04 39.37 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.045 -1.035 . . . . 0.0 110.219 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.571 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 0.0 OUTLIER -96.61 125.28 40.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.444 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.46 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 38.1 m-85 -108.83 147.37 32.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 110.133 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -95.37 -16.92 22.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -140.26 126.84 20.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.184 -0.947 . . . . 0.0 110.296 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 4.3 mt-10 -53.99 -42.97 69.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.244 -0.91 . . . . 0.0 110.23 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 t-105 -53.58 -48.31 69.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -58.84 -36.31 74.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.371 -0.831 . . . . 0.0 110.088 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.773 ' NH2' HG22 ' A' ' 76' ' ' THR . 2.2 tmt_? -59.45 -45.51 91.4 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -60.99 -38.25 85.36 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.137 -0.977 . . . . 0.0 110.674 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -65.51 -39.23 91.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 110.53 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.708 ' O ' HG22 ' A' ' 66' ' ' VAL . 30.5 t80 -56.24 -65.2 0.65 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.356 -0.84 . . . . 0.0 111.036 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.739 HD12 ' C ' ' A' ' 63' ' ' LEU . 4.6 pp -59.64 -10.31 3.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.221 -0.924 . . . . 0.0 110.841 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' SER . . . . . 0.512 ' N ' HD12 ' A' ' 63' ' ' LEU . 4.5 t -92.41 -23.61 19.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.098 -1.001 . . . . 0.0 110.699 -179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -95.5 -28.25 14.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.077 -1.015 . . . . 0.0 110.716 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 62' ' ' PHE . 3.5 m -109.37 75.07 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.044 -1.035 . . . . 0.0 110.138 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -50.83 111.57 0.57 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.288 -0.882 . . . . 0.0 110.229 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.499 HG23 ' HB ' ' A' ' 72' ' ' ILE . 0.5 OUTLIER -87.62 139.28 31.47 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 110.065 -179.647 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 68' ' ' ILE . 46.2 Cg_endo -56.5 179.01 0.11 Allowed 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.211 1.637 . . . . 0.0 110.56 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -86.36 -0.62 56.3 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.338 -0.851 . . . . 0.0 110.195 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.0 p -84.42 -30.5 25.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.282 -0.886 . . . . 0.0 109.765 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.598 HG23 ' O ' ' A' ' 8' ' ' LYS . 50.8 mt -94.34 114.76 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.013 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.539 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 7.0 m -95.53 146.08 24.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.195 -0.941 . . . . 0.0 109.933 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.526 ' CG2' ' CG2' ' A' ' 5' ' ' VAL . 8.2 p -145.2 154.32 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.129 -0.982 . . . . 0.0 110.749 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.99 -179.23 5.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 109.876 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.773 HG22 ' NH2' ' A' ' 59' ' ' ARG . 52.4 p -107.09 163.81 12.68 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.381 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -165.45 -177.86 38.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -147.9 144.15 27.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.201 -1.176 . . . . 0.0 110.333 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.527 ' SD ' HG21 ' A' ' 4' ' ' ILE . 97.2 mtp -115.29 172.46 7.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.265 -0.897 . . . . 0.0 110.147 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.473 ' HB3' ' O ' ' B' ' 76' ' ' THR . 2.2 t -132.72 101.76 5.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.937 . . . . 0.0 110.483 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.41 HG23 ' O ' ' A' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.126 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mtp . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.246 0.546 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.97 143.81 92.22 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.266 -0.896 . . . . 0.0 110.27 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.462 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 46.3 Cg_endo -93.4 137.14 1.29 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 O-C-N 124.03 1.542 . . . . 0.0 110.362 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.507 HG21 ' SD ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -143.13 176.73 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.391 -0.818 . . . . 0.0 110.025 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 74' ' ' VAL . 12.3 p -146.44 154.04 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 110.413 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.566 ' HD2' HG23 ' B' ' 50' ' ' THR . 0.2 OUTLIER -133.92 108.42 8.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 0.0 109.667 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.648 ' O ' HG23 ' B' ' 48' ' ' ILE . 2.5 pp -120.55 162.45 19.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.963 . . . . 0.0 110.687 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.616 ' O ' HG23 ' B' ' 72' ' ' ILE . 31.9 pttt -139.69 166.31 24.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.26 -0.9 . . . . 0.0 110.256 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 167.17 178.36 39.45 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -65.02 136.89 57.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.42 -1.047 . . . . 0.0 110.405 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.38 -25.13 3.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.325 -0.859 . . . . 0.0 110.117 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -80.52 -51.61 8.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.317 -0.864 . . . . 0.0 110.188 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 18.6 m -57.87 -16.54 12.14 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.248 -0.907 . . . . 0.0 110.041 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.6 mt -91.16 -28.74 17.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 110.237 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 18.0 ttmt -60.15 -48.67 80.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.29 -0.881 . . . . 0.0 110.638 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -70.15 -34.98 73.7 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.172 -0.955 . . . . 0.0 110.865 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.65 -48.12 82.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.064 -1.023 . . . . 0.0 110.505 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.559 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 71.4 ttt-85 -47.63 -32.64 5.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.593 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -64.28 -25.17 67.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -0.982 . . . . 0.0 109.953 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -74.69 -32.71 62.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.318 -0.864 . . . . 0.0 109.5 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 7.5 m-30 -66.65 -8.17 25.65 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 110.117 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -63.14 -50.09 71.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -75.14 -25.74 58.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.779 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.489 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 18.1 m170 -95.34 29.34 2.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.366 -0.834 . . . . 0.0 110.14 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 14.3 p -57.04 -19.73 20.6 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.104 -0.997 . . . . 0.0 110.208 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -97.06 9.54 41.82 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.851 . . . . 0.0 110.209 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.489 ' HB2' ' O ' ' B' ' 24' ' ' HIS . 4.2 mp -92.31 -34.13 14.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.22 -0.925 . . . . 0.0 110.564 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -117.9 168.92 10.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.005 -1.06 . . . . 0.0 110.417 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.71 -31.48 11.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.312 -0.867 . . . . 0.0 110.828 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.589 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.67 116.47 2.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.054 -1.029 . . . . 0.0 110.58 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.778 ' O ' HG13 ' B' ' 31' ' ' VAL . 12.0 p -90.27 101.12 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.116 -0.99 . . . . 0.0 110.333 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.56 ' HB2' ' CE3' ' A' ' 35' ' ' TRP . 60.0 p -50.38 152.51 1.82 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.081 -1.012 . . . . 0.0 110.376 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 33' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' B' ' 34' ' ' THR . 85.6 p -61.23 -95.93 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.884 . . . . 0.0 110.5 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.514 ' N ' ' OG ' ' B' ' 33' ' ' SER . 3.2 m -171.64 125.45 0.59 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.461 -0.774 . . . . 0.0 110.054 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.609 ' CE3' ' HB2' ' A' ' 32' ' ' SER . 36.1 p-90 -147.11 -168.77 3.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.375 -0.828 . . . . 0.0 110.075 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.52 ' HB2' ' HA ' ' B' ' 47' ' ' ALA . 82.2 t60 -162.58 170.77 18.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.146 -0.971 . . . . 0.0 110.079 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.498 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 4.5 m95 -79.91 98.34 7.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.112 -0.992 . . . . 0.0 110.154 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' THR . . . . . 0.53 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 2.3 m . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 0.0 110.189 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.532 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.251 0.548 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.648 HG23 ' O ' ' B' ' 7' ' ' LEU . 64.2 mt -142.38 162.43 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.227 -0.921 . . . . 0.0 110.12 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 t -136.49 168.05 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.098 -1.001 . . . . 0.0 110.725 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.566 HG23 ' HD2' ' B' ' 6' ' ' HIS . 78.4 m -145.94 153.87 41.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.439 -0.788 . . . . 0.0 109.677 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.544 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 0.5 OUTLIER -136.52 135.89 38.89 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.08 -1.013 . . . . 0.0 110.295 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.589 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 0.0 OUTLIER -96.59 124.98 40.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.505 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.462 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 40.5 m-85 -108.71 147.46 31.92 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.344 -0.848 . . . . 0.0 110.076 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -95.29 -17.66 21.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.094 -1.004 . . . . 0.0 110.273 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -139.22 127.33 22.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.403 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 4.2 mt-10 -54.37 -42.63 70.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 110.264 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -53.7 -48.45 69.55 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.209 -0.932 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -58.94 -36.04 74.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.098 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.776 ' NH2' HG22 ' B' ' 76' ' ' THR . 1.8 tmt_? -59.2 -45.73 90.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -0.847 . . . . 0.0 110.915 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.02 -37.94 84.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.027 -1.046 . . . . 0.0 110.774 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -65.67 -38.96 90.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.15 -0.968 . . . . 0.0 110.448 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.711 ' O ' HG22 ' B' ' 66' ' ' VAL . 31.4 t80 -56.25 -65.17 0.65 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.227 -0.921 . . . . 0.0 110.987 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.733 ' C ' HD12 ' B' ' 63' ' ' LEU . 4.6 pp -59.59 -11.54 5.0 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.292 -0.88 . . . . 0.0 110.951 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 64' ' ' SER . . . . . 0.526 ' N ' HD12 ' B' ' 63' ' ' LEU . 4.8 t -91.11 -23.48 20.28 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.014 -1.054 . . . . 0.0 110.663 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -95.57 -28.58 14.78 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.093 -1.005 . . . . 0.0 110.769 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.711 HG22 ' O ' ' B' ' 62' ' ' PHE . 3.5 m -109.02 74.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.095 -1.003 . . . . 0.0 110.231 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -50.12 111.67 0.56 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.382 -0.823 . . . . 0.0 110.108 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.496 HG23 ' HB ' ' B' ' 72' ' ' ILE . 0.5 OUTLIER -87.67 139.56 31.41 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.085 -1.01 . . . . 0.0 110.035 -179.638 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.445 ' HD2' HG23 ' B' ' 68' ' ' ILE . 47.3 Cg_endo -56.85 178.92 0.12 Allowed 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 124.156 1.608 . . . . 0.0 110.518 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -86.07 -0.8 56.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 58.8 p -84.41 -30.29 25.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.19 -0.944 . . . . 0.0 109.7 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.616 HG23 ' O ' ' B' ' 8' ' ' LYS . 47.9 mt -94.51 114.68 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.394 -0.816 . . . . 0.0 110.079 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 73' ' ' THR . . . . . 0.54 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.0 m -95.42 146.23 24.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 110.002 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 5' ' ' VAL . 8.4 p -145.22 154.34 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.159 -0.963 . . . . 0.0 110.857 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.43 -179.5 6.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.493 -0.754 . . . . 0.0 109.89 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 76' ' ' THR . . . . . 0.776 HG22 ' NH2' ' B' ' 59' ' ' ARG . 54.2 p -106.73 163.87 12.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.196 -0.94 . . . . 0.0 110.344 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -165.47 -177.52 37.87 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -148.24 144.23 27.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.151 -1.205 . . . . 0.0 110.347 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.507 ' SD ' HG21 ' B' ' 4' ' ' ILE . 96.6 mtp -115.18 172.95 6.76 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.283 -0.885 . . . . 0.0 110.108 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.412 ' O ' HG23 ' B' ' 81' ' ' ILE . 2.2 t -133.21 102.36 5.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 0.0 110.312 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.412 HG23 ' O ' ' B' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mmm . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 121.306 0.574 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.522 ' O ' ' CG ' ' A' ' 79' ' ' MET . 0.3 OUTLIER -103.14 101.31 21.2 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 110.186 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.503 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -56.37 164.42 5.42 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.904 1.476 . . . . 0.0 110.243 -179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' A' ' 77' ' ' GLY . 1.3 pt -144.01 125.39 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.172 -0.955 . . . . 0.0 110.187 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.542 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 5.6 p -94.34 132.56 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.211 -0.931 . . . . 0.0 110.246 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.579 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.1 OUTLIER -105.28 126.23 51.87 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.767 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.894 ' CD1' HG23 ' A' ' 72' ' ' ILE . 13.0 tp -115.01 133.65 55.86 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.16 -0.962 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.521 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.1 tttt -141.15 166.38 24.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.335 -0.853 . . . . 0.0 109.974 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.521 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.32 -171.55 32.22 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.751 -1.339 . . . . 0.0 109.751 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.0 136.08 56.38 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -1.158 . . . . 0.0 110.39 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.537 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.81 -48.41 59.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.303 -0.873 . . . . 0.0 110.652 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.8 -56.17 13.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.082 -1.011 . . . . 0.0 110.487 -179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.4 m -58.19 -26.0 62.26 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.164 -0.96 . . . . 0.0 110.786 -179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.816 ' HA ' HD12 ' A' ' 17' ' ' LEU . 56.1 mt -71.86 -31.89 66.92 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.117 -0.989 . . . . 0.0 110.379 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -59.69 -42.7 93.53 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.216 -0.928 . . . . 0.0 110.567 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.4 -37.53 74.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.212 -0.93 . . . . 0.0 111.002 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 14' ' ' LEU . 42.8 mt -58.8 -55.44 35.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.071 -1.018 . . . . 0.0 110.594 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttp85 -45.59 -21.55 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.241 -0.912 . . . . 0.0 110.919 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 17' ' ' LEU . 67.0 t80 -64.41 -59.33 4.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.083 -1.011 . . . . 0.0 110.678 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.5 mtt-85 -68.16 -14.72 63.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 0.0 110.417 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.62 -41.05 88.98 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.253 -0.904 . . . . 0.0 110.573 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -63.51 -25.13 68.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.171 -0.955 . . . . 0.0 110.668 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -75.28 -38.66 60.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 110.575 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.877 ' HB3' HD12 ' A' ' 27' ' ' LEU . 23.1 m-70 -94.73 45.25 1.11 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.399 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.604 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 20.0 p -57.32 -16.1 7.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.349 -0.844 . . . . 0.0 110.229 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.573 HG23 ' SG ' ' A' ' 25' ' ' CYS . 65.3 p -96.85 3.62 52.11 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.454 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.877 HD12 ' HB3' ' A' ' 24' ' ' HIS . 8.0 mt -91.75 -26.28 18.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 0.0 110.137 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.604 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 44.0 p90 -122.13 174.22 7.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.158 -0.964 . . . . 0.0 109.936 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.6 m -101.0 -36.36 9.05 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.118 -0.989 . . . . 0.0 111.949 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.493 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -160.51 123.99 3.47 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.855 -1.153 . . . . 0.0 110.941 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.614 ' O ' HG13 ' A' ' 31' ' ' VAL . 8.5 p -89.62 120.46 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.176 -0.952 . . . . 0.0 110.049 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.64 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 4.4 p -84.21 150.18 25.64 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.321 -0.862 . . . . 0.0 110.953 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.533 ' HB2' ' CE1' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -61.39 158.52 14.4 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.523 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.5 m -67.77 134.58 51.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.021 -1.049 . . . . 0.0 109.962 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.668 ' CD2' ' O ' ' A' ' 35' ' ' TRP . 46.9 p-90 -145.49 120.7 10.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.106 -0.996 . . . . 0.0 109.917 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.693 ' ND1' HG22 ' A' ' 38' ' ' THR . 0.3 OUTLIER -79.02 161.29 26.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.212 -0.93 . . . . 0.0 110.614 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.585 ' CE3' ' HA ' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -78.62 55.5 1.66 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.929 179.761 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.693 HG22 ' ND1' ' A' ' 36' ' ' HIS . 6.0 t . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.197 -0.939 . . . . 0.0 110.228 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.284 0.564 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.813 HG23 ' O ' ' A' ' 7' ' ' LEU . 25.9 mt -141.5 140.97 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.162 -0.961 . . . . 0.0 110.599 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.447 HG12 HD11 ' A' ' 51' ' ' LEU . 48.5 t -121.94 117.81 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.386 -0.821 . . . . 0.0 109.933 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.766 ' C ' HD12 ' A' ' 51' ' ' LEU . 39.2 m -94.15 154.63 17.48 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.192 -0.943 . . . . 0.0 110.49 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.766 HD12 ' C ' ' A' ' 50' ' ' THR . 5.6 mp -135.91 134.72 39.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.234 -0.916 . . . . 0.0 109.889 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.527 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.85 127.49 42.88 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.324 -0.86 . . . . 0.0 110.757 -179.44 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.503 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 15.9 m-85 -109.13 147.84 31.82 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.459 -0.775 . . . . 0.0 109.976 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -88.22 -10.09 50.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.23 -0.919 . . . . 0.0 110.765 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.19 132.42 10.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.116 -0.99 . . . . 0.0 110.319 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 30.1 mm-40 -54.47 -38.15 66.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.304 -0.873 . . . . 0.0 110.054 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -53.65 -53.54 50.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.025 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -57.07 -27.23 61.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.421 -0.8 . . . . 0.0 110.256 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.462 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 25.0 ttt-85 -59.62 -49.57 77.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.182 -0.949 . . . . 0.0 110.257 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -61.37 -33.09 73.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.364 -0.835 . . . . 0.0 110.914 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -65.19 -49.59 69.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.988 -1.07 . . . . 0.0 110.158 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.867 ' CE2' HG21 ' A' ' 66' ' ' VAL . 0.6 OUTLIER -55.4 -41.43 72.69 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.214 -0.929 . . . . 0.0 109.639 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.492 HD23 HD11 ' A' ' 68' ' ' ILE . 2.6 mt -59.77 -24.61 64.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.426 -0.796 . . . . 0.0 110.374 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.7 p -91.77 -19.01 23.04 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.165 -0.959 . . . . 0.0 110.32 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.74 -17.26 20.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.21 -0.931 . . . . 0.0 110.141 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.867 HG21 ' CE2' ' A' ' 62' ' ' PHE . 30.9 t -102.17 97.46 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.319 -0.863 . . . . 0.0 110.329 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.524 ' CD ' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -56.62 104.52 0.15 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.224 -0.922 . . . . 0.0 110.15 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.609 HG23 ' HB ' ' A' ' 72' ' ' ILE . 7.0 mt -89.85 136.44 29.23 Favored Pre-proline 0 C--N 1.301 -1.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.278 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.548 ' HG2' HD13 ' A' ' 72' ' ' ILE . 45.8 Cg_endo -76.76 -158.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.034 1.544 . . . . 0.0 110.214 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.525 ' O ' HG23 ' A' ' 71' ' ' THR . 39.0 mttp -100.92 45.38 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.491 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 70' ' ' LYS . 0.7 OUTLIER -154.69 -10.87 0.13 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.063 -1.023 . . . . 0.0 112.1 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.894 HG23 ' CD1' ' A' ' 7' ' ' LEU . 1.2 mp -94.2 113.74 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 120.596 -1.315 . . . . 0.0 109.962 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.5 m -95.59 144.38 26.09 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.104 -0.997 . . . . 0.0 110.449 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.461 HG12 ' N ' ' A' ' 75' ' ' SER . 24.7 t -90.15 167.09 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 111.085 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.579 ' HB2' ' CB ' ' A' ' 6' ' ' HIS . 1.2 m -144.39 164.45 30.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.671 -0.643 . . . . 0.0 110.895 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.7 p -133.93 156.22 48.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.438 -0.788 . . . . 0.0 109.282 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' A' ' 4' ' ' ILE . . . 176.11 138.58 2.9 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -92.57 140.56 29.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.129 -1.218 . . . . 0.0 110.255 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.614 ' CE ' HD12 ' A' ' 81' ' ' ILE . 2.8 ppp? -126.91 168.55 14.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.138 -0.976 . . . . 0.0 110.309 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.485 ' O ' HG13 ' A' ' 81' ' ' ILE . 0.5 OUTLIER -148.86 108.97 4.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.243 -0.91 . . . . 0.0 110.25 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.614 HD12 ' CE ' ' A' ' 79' ' ' MET . 27.7 mt . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.194 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.4 ' HE3' ' HB3' ' B' ' 1' ' ' MET . 3.2 mmm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.278 0.561 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 2' ' ' THR . . . . . 0.546 ' O ' ' CG ' ' B' ' 79' ' ' MET . 0.3 OUTLIER -102.84 100.52 16.86 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.216 -0.927 . . . . 0.0 110.285 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.3 Cg_endo -55.5 164.58 4.01 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 O-C-N 123.974 1.513 . . . . 0.0 110.325 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' B' ' 77' ' ' GLY . 1.3 pt -144.29 125.1 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.936 . . . . 0.0 110.227 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.536 ' CG1' ' HB2' ' B' ' 51' ' ' LEU . 5.5 p -94.23 132.41 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.13 -0.981 . . . . 0.0 110.303 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.584 ' CB ' ' HB2' ' B' ' 75' ' ' SER . 0.1 OUTLIER -105.07 126.5 52.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 109.9 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.889 ' CD1' HG23 ' B' ' 72' ' ' ILE . 13.4 tp -115.34 133.57 55.91 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.089 -1.007 . . . . 0.0 110.591 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.532 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 8.7 tttt -141.2 166.47 24.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.326 -0.859 . . . . 0.0 109.885 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.532 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.53 -171.28 32.36 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.96 136.27 56.62 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.36 -1.083 . . . . 0.0 110.354 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.528 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.7 -49.38 57.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.382 -0.823 . . . . 0.0 110.607 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.11 -56.13 12.15 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.704 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 4.2 m -58.0 -26.85 62.91 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.182 -0.949 . . . . 0.0 110.846 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.835 ' HA ' HD12 ' B' ' 17' ' ' LEU . 60.1 mt -70.98 -31.86 68.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.104 -0.998 . . . . 0.0 110.52 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -59.75 -42.66 93.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.625 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 6.0 t -70.17 -37.32 75.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.195 -0.941 . . . . 0.0 110.837 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.835 HD12 ' HA ' ' B' ' 14' ' ' LEU . 48.7 mt -58.8 -55.81 30.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.252 -0.905 . . . . 0.0 110.708 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ttp85 -45.75 -21.16 0.1 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.88 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' B' ' 17' ' ' LEU . 67.2 t80 -64.58 -60.18 3.42 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.025 -1.047 . . . . 0.0 110.527 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 48.2 mtt-85 -67.48 -14.73 63.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.165 -0.96 . . . . 0.0 110.473 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.64 -40.83 88.87 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.193 -0.942 . . . . 0.0 110.585 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 20.4 mmtp -63.37 -25.45 68.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.26 -0.9 . . . . 0.0 110.677 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.18 -39.04 60.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 110.574 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.864 ' HB3' HD12 ' B' ' 27' ' ' LEU . 23.9 m-70 -94.35 45.12 1.12 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.083 -1.011 . . . . 0.0 110.276 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.623 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 20.9 p -57.14 -15.91 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.212 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.575 HG23 ' SG ' ' B' ' 25' ' ' CYS . 80.4 p -96.86 3.09 52.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.325 -0.859 . . . . 0.0 110.446 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.864 HD12 ' HB3' ' B' ' 24' ' ' HIS . 8.2 mt -91.75 -25.64 18.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.158 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.623 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 44.5 p90 -122.5 173.82 7.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.147 -0.971 . . . . 0.0 109.958 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -100.69 -36.13 9.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.986 -1.071 . . . . 0.0 111.742 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.485 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -160.68 123.93 3.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.845 -1.159 . . . . 0.0 111.059 -179.697 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.615 ' O ' HG13 ' B' ' 31' ' ' VAL . 8.7 p -89.47 119.95 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.161 -0.962 . . . . 0.0 110.037 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.644 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 3.9 p -83.92 150.82 25.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.298 -0.876 . . . . 0.0 110.832 -179.385 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 33' ' ' SER . . . . . 0.52 ' HB2' ' CE1' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -61.45 158.81 13.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.027 -1.045 . . . . 0.0 109.734 179.337 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.0 m -68.01 134.76 51.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.028 -1.045 . . . . 0.0 109.899 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.664 ' O ' ' CD2' ' B' ' 35' ' ' TRP . 46.1 p-90 -145.83 120.6 9.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.101 -1.0 . . . . 0.0 109.937 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.649 ' ND1' HG22 ' B' ' 38' ' ' THR . 0.3 OUTLIER -78.94 161.3 26.78 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.235 -0.915 . . . . 0.0 110.593 -179.646 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.588 ' HA ' ' CE3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -78.65 53.48 1.34 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.259 -0.9 . . . . 0.0 110.165 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 38' ' ' THR . . . . . 0.649 HG22 ' ND1' ' B' ' 36' ' ' HIS . 6.6 t . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.363 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 121.244 0.545 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.831 HG23 ' O ' ' B' ' 7' ' ' LEU . 40.8 mt -141.87 140.99 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.2 -0.937 . . . . 0.0 110.617 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 49' ' ' VAL . . . . . 0.463 HG12 HD11 ' B' ' 51' ' ' LEU . 48.1 t -121.67 117.81 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 0.0 109.943 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.765 ' C ' HD12 ' B' ' 51' ' ' LEU . 34.9 m -93.95 154.32 17.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 110.374 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.765 HD12 ' C ' ' B' ' 50' ' ' THR . 5.7 mp -135.81 134.78 39.27 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 109.804 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.514 ' OG1' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.84 127.59 42.97 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 110.627 -179.542 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.496 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 16.1 m-85 -109.43 148.02 31.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.449 -0.782 . . . . 0.0 109.737 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -88.25 -9.73 51.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.131 -0.981 . . . . 0.0 110.725 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.07 133.01 10.51 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.464 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 28.5 mm-40 -55.31 -38.34 68.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -0.875 . . . . 0.0 109.984 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -53.57 -53.29 53.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.34 -0.85 . . . . 0.0 109.884 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -56.72 -27.99 60.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 110.143 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.464 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 24.0 ttt-85 -59.54 -49.17 78.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.19 -0.944 . . . . 0.0 110.395 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -61.47 -33.02 73.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.242 -0.911 . . . . 0.0 110.899 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -65.37 -49.85 67.74 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.152 -0.968 . . . . 0.0 110.063 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.881 ' CE2' HG21 ' B' ' 66' ' ' VAL . 0.6 OUTLIER -55.52 -41.11 72.69 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.275 -0.891 . . . . 0.0 109.642 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.497 HD23 ' CD1' ' B' ' 68' ' ' ILE . 2.6 mt -59.75 -25.58 64.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.413 -0.804 . . . . 0.0 110.178 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 26.0 p -90.48 -19.5 23.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.62 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.83 -17.1 20.42 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.881 HG21 ' CE2' ' B' ' 62' ' ' PHE . 34.8 t -102.04 96.94 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.211 -0.931 . . . . 0.0 110.374 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 67' ' ' LYS . . . . . 0.526 ' CD ' ' O ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -56.13 104.32 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 110.254 179.872 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.595 HG23 ' HB ' ' B' ' 72' ' ' ILE . 6.8 mt -89.88 136.88 28.66 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.92 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.553 ' HG2' HD13 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -77.19 -157.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.127 1.593 . . . . 0.0 110.296 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.513 ' O ' HG23 ' B' ' 71' ' ' THR . 39.3 mttp -101.5 45.24 0.98 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 110.368 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 71' ' ' THR . . . . . 0.513 HG23 ' O ' ' B' ' 70' ' ' LYS . 0.7 OUTLIER -154.76 -10.72 0.13 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.094 -1.004 . . . . 0.0 112.04 -179.745 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.889 HG23 ' CD1' ' B' ' 7' ' ' LEU . 1.2 mp -94.38 113.84 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 120.553 -1.342 . . . . 0.0 109.971 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m -95.44 144.24 26.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.037 -1.039 . . . . 0.0 110.351 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.468 HG12 ' N ' ' B' ' 75' ' ' SER . 24.1 t -90.13 167.14 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 111.084 -178.865 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 75' ' ' SER . . . . . 0.584 ' HB2' ' CB ' ' B' ' 6' ' ' HIS . 1.3 m -144.59 163.72 33.06 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.409 0.623 . . . . 0.0 110.955 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.3 p -133.13 156.91 46.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.5 -0.75 . . . . 0.0 109.222 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' B' ' 4' ' ' ILE . . . 175.69 138.72 2.89 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -92.71 140.63 29.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.074 -1.251 . . . . 0.0 110.243 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.586 ' CE ' HD12 ' B' ' 81' ' ' ILE . 2.7 ppp? -126.55 169.38 13.13 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 110.19 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.48 ' O ' HG13 ' B' ' 81' ' ' ILE . 0.5 OUTLIER -149.95 108.77 3.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.216 -0.928 . . . . 0.0 110.127 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.586 HD12 ' CE ' ' B' ' 79' ' ' MET . 27.0 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.686 ' HE2' ' CD2' ' A' ' 78' ' ' PHE . 1.8 mtp . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.116 0.484 . . . . 0.0 110.094 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -98.79 122.34 53.27 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.133 -0.979 . . . . 0.0 110.734 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 46.7 Cg_endo -80.41 164.04 21.65 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 124.023 1.538 . . . . 0.0 109.716 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 4' ' ' ILE . 4.7 pt -143.26 124.0 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.07 -1.018 . . . . 0.0 110.755 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.593 ' O ' HG13 ' A' ' 5' ' ' VAL . 11.2 p -95.14 124.68 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.441 -0.787 . . . . 0.0 110.353 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.495 ' O ' ' HB2' ' A' ' 75' ' ' SER . 0.3 OUTLIER -107.24 127.57 53.65 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.154 -0.966 . . . . 0.0 110.272 179.755 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.802 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.7 OUTLIER -129.29 153.58 47.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.06 -1.025 . . . . 0.0 110.507 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.493 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 1.2 ttpm? -141.85 169.8 16.91 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.179 -0.951 . . . . 0.0 110.2 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.493 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.22 -175.46 31.66 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -65.05 146.47 54.96 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -1.076 . . . . 0.0 110.549 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.959 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.42 -48.64 56.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.343 -0.848 . . . . 0.0 110.421 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.435 ' OD1' ' N ' ' A' ' 12' ' ' ASN . 3.3 m120 -53.93 -48.87 69.78 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.156 -0.965 . . . . 0.0 110.678 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.476 HG21 ' OG1' ' A' ' 71' ' ' THR . 0.2 OUTLIER -58.27 -20.61 43.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.239 -0.913 . . . . 0.0 110.98 -179.604 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.959 HD12 ' HA ' ' A' ' 11' ' ' ALA . 51.5 mt -75.61 -39.41 57.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.059 -1.025 . . . . 0.0 110.607 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -60.29 -26.39 66.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.154 -0.966 . . . . 0.0 110.505 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.52 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 29.1 t -69.94 -54.01 15.27 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.285 -0.885 . . . . 0.0 110.843 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.588 HD11 HG13 ' A' ' 72' ' ' ILE . 42.2 mt -59.19 -53.19 61.13 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.048 -1.033 . . . . 0.0 110.566 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -46.63 -25.63 0.75 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.422 -0.799 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.52 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 39.1 t80 -64.85 -39.95 94.37 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.968 -1.082 . . . . 0.0 110.514 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.26 -23.76 60.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.514 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 10.3 m-30 -66.42 -27.94 68.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.167 -0.958 . . . . 0.0 110.346 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mmtt -63.58 -42.46 98.31 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.238 -0.914 . . . . 0.0 110.151 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 mmtm -75.12 -40.35 59.92 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.323 -0.861 . . . . 0.0 110.353 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.412 ' HB3' HD22 ' A' ' 27' ' ' LEU . 41.5 m-70 -94.91 39.63 1.1 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.228 -0.92 . . . . 0.0 110.446 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 10.1 p -57.5 -14.69 5.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.267 -0.896 . . . . 0.0 110.593 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.8 p -96.77 3.97 52.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.972 . . . . 0.0 110.403 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.412 HD22 ' HB3' ' A' ' 24' ' ' HIS . 3.3 mp -92.28 -22.89 19.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.234 -0.916 . . . . 0.0 110.434 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 37.4 p90 -130.06 -177.1 4.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.191 -0.943 . . . . 0.0 109.799 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.9 m -95.67 -64.23 1.08 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.016 -1.052 . . . . 0.0 110.333 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.52 145.5 18.97 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.785 -1.197 . . . . 0.0 109.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.669 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.4 p -91.77 102.6 13.69 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.634 -0.666 . . . . 0.0 110.418 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.47 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 2.6 p -52.35 154.52 2.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.08 -1.013 . . . . 0.0 109.598 179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 p -60.56 158.77 11.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.146 -0.971 . . . . 0.0 110.07 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -67.54 126.25 28.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.142 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.502 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 32.7 p-90 -146.24 173.27 12.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.987 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.502 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 4.9 t60 -162.72 -178.26 6.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.125 -0.984 . . . . 0.0 110.687 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 48.8 m95 -79.37 92.37 5.18 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.469 -0.769 . . . . 0.0 110.158 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 72.6 p . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.291 -0.881 . . . . 0.0 110.399 -179.762 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.403 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.314 0.578 . . . . 0.0 110.52 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.802 HG23 ' O ' ' A' ' 7' ' ' LEU . 58.0 mt -145.92 150.33 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.333 -0.855 . . . . 0.0 110.435 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.1 t -122.71 170.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 109.805 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.9 m -145.76 156.58 43.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.065 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 mp -136.24 133.11 36.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.223 -0.923 . . . . 0.0 110.31 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.503 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 18.5 m -96.81 130.57 44.05 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.361 -0.837 . . . . 0.0 110.219 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.542 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 11.7 m-85 -110.43 147.99 32.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.178 -0.951 . . . . 0.0 109.987 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -78.9 -3.42 44.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.145 -0.972 . . . . 0.0 110.669 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.49 139.65 1.67 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -56.63 -31.93 64.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.907 . . . . 0.0 109.785 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -55.05 -59.74 4.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.606 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -57.31 -36.76 71.5 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.913 . . . . 0.0 111.152 -178.657 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 ttp85 -59.26 -40.98 87.74 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.984 -1.072 . . . . 0.0 110.512 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.54 -40.91 96.37 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.273 -0.892 . . . . 0.0 110.745 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -65.66 -40.35 92.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.121 -0.987 . . . . 0.0 110.537 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.625 ' CE2' HG21 ' A' ' 66' ' ' VAL . 9.4 t80 -55.45 -45.5 76.83 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.153 -0.967 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.55 -16.56 25.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.38 -0.825 . . . . 0.0 110.382 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -22.73 19.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.12 -0.987 . . . . 0.0 110.309 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -95.51 -26.52 15.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.038 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.625 HG21 ' CE2' ' A' ' 62' ' ' PHE . 87.0 t -107.09 75.07 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.874 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.78 104.68 0.47 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.197 -0.94 . . . . 0.0 109.886 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.621 HD12 ' H ' ' A' ' 68' ' ' ILE . 0.8 OUTLIER -88.51 134.92 33.26 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.278 -0.889 . . . . 0.0 109.701 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.591 ' HD2' HG22 ' A' ' 68' ' ' ILE . 44.4 Cg_endo -54.77 -160.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.172 1.617 . . . . 0.0 110.561 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 tttm -95.47 2.98 54.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.907 -179.295 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.476 ' OG1' HG21 ' A' ' 13' ' ' THR . 4.5 p -85.24 -28.59 25.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.076 -1.015 . . . . 0.0 110.774 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.588 HG13 HD11 ' A' ' 17' ' ' LEU . 12.8 mm -94.21 124.57 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.49 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 6.4 t -96.34 138.3 34.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.361 -0.837 . . . . 0.0 110.011 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.01 165.81 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.083 -1.011 . . . . 0.0 111.103 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.495 ' HB2' ' O ' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.23 155.43 45.26 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 110.524 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.6 p -133.67 134.15 42.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.288 -0.882 . . . . 0.0 110.339 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.49 -169.38 25.79 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.599 -1.401 . . . . 0.0 109.599 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.686 ' CD2' ' HE2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -148.07 150.86 34.66 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.378 -1.072 . . . . 0.0 110.165 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HE3' ' A' ' 1' ' ' MET . 26.6 mtp -122.72 158.24 30.56 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.621 ' C ' HD12 ' A' ' 81' ' ' ILE . 0.2 OUTLIER -144.42 111.89 6.06 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 110.114 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.621 HD12 ' C ' ' A' ' 80' ' ' SER . 3.1 mp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.144 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.663 ' HE2' ' CD2' ' B' ' 78' ' ' PHE . 1.7 mtp . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.194 0.521 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 17.6 p -98.52 122.55 53.12 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 0.0 110.678 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.538 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 46.4 Cg_endo -80.69 163.88 21.0 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 123.982 1.517 . . . . 0.0 109.949 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.44 ' O ' HG13 ' B' ' 4' ' ' ILE . 4.9 pt -142.94 123.68 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.108 -0.995 . . . . 0.0 110.813 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.593 ' O ' HG13 ' B' ' 5' ' ' VAL . 11.5 p -94.78 124.94 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 110.319 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' B' ' 75' ' ' SER . 0.3 OUTLIER -107.07 127.16 53.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.197 -0.939 . . . . 0.0 110.192 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.814 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.7 OUTLIER -129.11 153.31 47.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.048 -1.032 . . . . 0.0 110.457 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.495 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 1.2 ttpm? -142.05 169.95 16.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.285 -0.885 . . . . 0.0 110.192 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.495 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.04 -175.27 31.6 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.09 146.01 55.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.29 -1.124 . . . . 0.0 110.583 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.94 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.17 -47.05 54.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.389 -0.819 . . . . 0.0 110.631 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 12' ' ' ASN . . . . . 0.448 ' OD1' ' N ' ' B' ' 12' ' ' ASN . 3.1 m120 -56.05 -48.32 76.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.13 -0.981 . . . . 0.0 110.649 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.487 HG21 ' OG1' ' B' ' 71' ' ' THR . 0.2 OUTLIER -58.15 -21.28 46.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.221 -0.924 . . . . 0.0 110.69 -179.563 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' B' ' 11' ' ' ALA . 54.5 mt -74.63 -39.81 61.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.99 -1.069 . . . . 0.0 110.647 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.48 -26.17 66.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.144 -0.973 . . . . 0.0 110.619 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.532 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 29.4 t -69.81 -53.77 16.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 110.768 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.583 HD11 HG13 ' B' ' 72' ' ' ILE . 39.8 mt -59.23 -53.55 56.95 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.16 -0.962 . . . . 0.0 110.616 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 0.3 OUTLIER -46.47 -25.51 0.69 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.315 -0.865 . . . . 0.0 111.154 -179.358 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.532 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 40.1 t80 -64.9 -40.35 94.95 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.004 -1.06 . . . . 0.0 110.458 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.18 -23.53 60.44 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.141 -0.975 . . . . 0.0 110.584 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.535 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 10.2 m-30 -66.37 -28.05 68.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.147 -0.971 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 mmtt -63.62 -42.21 98.21 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 110.185 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -75.18 -40.41 59.44 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 110.313 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -95.05 39.78 1.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.192 -0.943 . . . . 0.0 110.405 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.507 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 9.4 p -57.62 -14.83 5.97 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.335 -0.853 . . . . 0.0 110.361 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 29.9 p -96.65 3.91 52.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.219 -0.925 . . . . 0.0 110.303 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 mp -92.25 -23.17 19.41 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.236 -0.915 . . . . 0.0 110.364 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.507 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 39.9 p90 -129.6 -177.0 4.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.203 -0.936 . . . . 0.0 109.783 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -95.33 -64.55 1.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.065 -1.022 . . . . 0.0 110.294 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.58 145.2 18.67 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 120.905 -1.122 . . . . 0.0 109.004 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.653 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.7 p -91.77 102.66 13.75 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.74 -0.6 . . . . 0.0 110.471 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 2.6 p -51.87 154.2 2.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.053 -1.029 . . . . 0.0 109.835 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 2.9 p -60.76 158.82 12.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.015 -1.053 . . . . 0.0 109.898 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.71 126.63 30.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.491 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 33.4 p-90 -146.45 173.2 12.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.26 -0.9 . . . . 0.0 110.022 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.491 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 5.0 t60 -162.66 -178.45 6.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.149 -0.97 . . . . 0.0 110.655 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.503 ' CH2' ' OG1' ' A' ' 52' ' ' THR . 55.0 m95 -79.33 92.97 5.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.444 -0.785 . . . . 0.0 110.076 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 70.7 p . . . . . 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 110.256 -179.827 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.407 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.291 0.567 . . . . 0.0 110.586 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.814 HG23 ' O ' ' B' ' 7' ' ' LEU . 56.4 mt -145.99 150.05 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.348 -0.845 . . . . 0.0 110.376 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 2.1 t -122.79 170.13 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.216 -0.927 . . . . 0.0 109.857 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 73.3 m -145.46 156.53 43.8 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.158 -0.964 . . . . 0.0 110.14 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 mp -136.23 133.65 37.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.889 . . . . 0.0 110.197 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 19.8 m -96.97 130.65 44.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.313 -0.867 . . . . 0.0 110.192 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.538 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 16.3 m-85 -110.06 147.53 33.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.176 -0.953 . . . . 0.0 110.03 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -78.9 -2.95 42.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.727 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.52 139.04 1.21 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.151 -0.968 . . . . 0.0 110.162 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -56.22 -32.31 64.31 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.284 -0.885 . . . . 0.0 109.809 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 17.1 t-105 -54.7 -59.81 4.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 110.612 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.16 -36.73 71.11 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 111.065 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 48.5 ttp85 -59.16 -41.12 87.62 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.937 -1.102 . . . . 0.0 110.627 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.28 -41.25 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.117 -0.99 . . . . 0.0 110.672 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -65.46 -39.78 92.43 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.165 -0.959 . . . . 0.0 110.56 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.607 ' CE2' HG21 ' B' ' 66' ' ' VAL . 10.1 t80 -55.59 -45.96 77.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.141 -0.974 . . . . 0.0 109.624 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.4 mt -59.72 -15.07 17.13 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.453 -0.78 . . . . 0.0 110.459 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -22.95 18.09 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.068 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -95.02 -26.6 16.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.267 -0.896 . . . . 0.0 109.886 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.607 HG21 ' CE2' ' B' ' 62' ' ' PHE . 89.8 t -107.17 75.55 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.229 -0.919 . . . . 0.0 110.106 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 104.79 0.51 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.186 -0.946 . . . . 0.0 109.936 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.6 ' H ' HD12 ' B' ' 68' ' ' ILE . 0.8 OUTLIER -88.62 135.1 32.79 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.287 -0.883 . . . . 0.0 109.834 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.579 ' HD2' HG22 ' B' ' 68' ' ' ILE . 43.7 Cg_endo -54.76 -160.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.052 1.554 . . . . 0.0 110.706 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' B' ' 70' ' ' LYS . 29.7 tttm -94.66 2.6 55.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.193 -0.942 . . . . 0.0 110.837 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 71' ' ' THR . . . . . 0.487 ' OG1' HG21 ' B' ' 13' ' ' THR . 4.6 p -85.32 -28.64 25.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.12 -0.988 . . . . 0.0 110.972 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.583 HG13 HD11 ' B' ' 17' ' ' LEU . 12.8 mm -94.32 124.36 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.143 -0.973 . . . . 0.0 111.035 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 73' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.3 t -96.18 138.54 33.64 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.001 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -89.87 166.25 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.067 -1.021 . . . . 0.0 111.053 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 75' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -142.67 155.29 44.89 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.647 -0.658 . . . . 0.0 110.427 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.2 p -133.3 134.26 43.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.07 -170.14 26.4 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.663 ' CD2' ' HE2' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.86 150.24 33.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.234 -1.156 . . . . 0.0 110.129 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.419 ' O ' ' HB3' ' B' ' 1' ' ' MET . 24.5 mtp -122.18 157.76 30.86 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.901 . . . . 0.0 110.344 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.624 ' C ' HD12 ' B' ' 81' ' ' ILE . 0.2 OUTLIER -144.41 112.21 6.23 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.26 -0.9 . . . . 0.0 109.921 179.812 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.655 ' OXT' HG22 ' B' ' 81' ' ' ILE . 3.0 mp . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.122 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.207 0.527 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.421 ' O ' HG23 ' A' ' 4' ' ' ILE . 23.9 p -125.11 109.85 27.15 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.296 -0.877 . . . . 0.0 110.106 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -50.75 149.48 14.09 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.003 1.528 . . . . 0.0 110.364 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.865 HD11 ' HA3' ' A' ' 77' ' ' GLY . 1.0 OUTLIER -143.49 175.84 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.786 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.734 HG13 HG11 ' A' ' 74' ' ' VAL . 78.4 t -145.68 121.11 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.173 -0.955 . . . . 0.0 110.168 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.47 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.39 125.72 51.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.243 -0.911 . . . . 0.0 110.333 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.579 ' O ' HG23 ' A' ' 48' ' ' ILE . 3.3 mp -117.65 141.38 48.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.275 -0.89 . . . . 0.0 110.072 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.524 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 20.5 tptp -139.09 160.44 39.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.968 . . . . 0.0 110.455 -179.08 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.524 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 156.75 -156.76 27.43 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . 0.481 ' OD1' ' HB2' ' A' ' 12' ' ' ASN . 6.9 t70 -65.14 124.93 23.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.306 -1.114 . . . . 0.0 110.452 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.929 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.16 -36.09 28.77 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.261 -0.9 . . . . 0.0 110.388 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.481 ' HB2' ' OD1' ' A' ' 10' ' ' ASP . 3.9 m-20 -69.2 -46.83 66.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.162 -0.961 . . . . 0.0 110.682 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.534 ' CG2' HD11 ' A' ' 72' ' ' ILE . 54.9 m -57.69 -24.05 54.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.148 -0.97 . . . . 0.0 110.298 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.968 ' HA ' HD12 ' A' ' 17' ' ' LEU . 51.9 mt -69.06 -32.36 71.76 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.415 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -59.59 -38.24 80.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 110.373 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 5.8 t -70.08 -36.64 75.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.158 -0.964 . . . . 0.0 110.506 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.968 HD12 ' HA ' ' A' ' 14' ' ' LEU . 31.6 mt -58.6 -50.9 72.13 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.239 -0.913 . . . . 0.0 110.308 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.576 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 11.0 ttm180 -46.4 -27.21 1.0 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.147 -0.971 . . . . 0.0 110.548 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.456 ' CD1' ' C ' ' A' ' 19' ' ' TYR . 9.5 t80 -64.93 -42.08 94.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.141 -0.974 . . . . 0.0 110.612 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -72.13 -22.4 61.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.086 -1.009 . . . . 0.0 110.447 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.576 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 12.8 m-30 -66.58 -9.85 39.52 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.131 -0.981 . . . . 0.0 110.275 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -63.59 -50.92 67.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.257 -0.902 . . . . 0.0 110.536 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -75.14 -14.75 60.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.121 -0.987 . . . . 0.0 110.313 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.758 ' CD2' HD12 ' A' ' 27' ' ' LEU . 2.0 m80 -94.92 19.89 9.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.183 -0.948 . . . . 0.0 110.221 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.496 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 24.5 p -56.83 -24.76 53.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 0.0 110.052 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.463 HG22 ' H ' ' A' ' 26' ' ' THR . 3.5 t -97.08 3.48 51.75 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 110.161 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.758 HD12 ' CD2' ' A' ' 24' ' ' HIS . 23.9 mt -92.13 -32.49 15.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.507 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.496 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 50.8 p90 -117.6 167.53 11.24 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.039 -1.038 . . . . 0.0 109.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.8 m -100.26 -31.09 11.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.185 -0.947 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.93 117.03 2.56 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.104 -0.998 . . . . 0.0 110.792 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.498 ' O ' HG13 ' A' ' 31' ' ' VAL . 3.0 p -89.04 114.71 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.211 -0.931 . . . . 0.0 110.146 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.597 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 88.5 p -68.18 143.31 55.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.461 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 2.2 p -61.41 162.06 8.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.284 -0.885 . . . . 0.0 110.128 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.851 ' CG2' ' HB1' ' A' ' 47' ' ' ALA . 91.3 m -67.96 134.57 50.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.224 -0.922 . . . . 0.0 110.098 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.534 ' O ' ' N ' ' A' ' 48' ' ' ILE . 41.9 p-90 -146.52 -179.21 6.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.141 -0.975 . . . . 0.0 109.921 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.607 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 46.1 t60 -162.52 174.32 12.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.992 . . . . 0.0 110.417 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.607 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 89.0 m95 -78.43 105.39 9.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.87 . . . . 0.0 110.185 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.41 -0.806 . . . . 0.0 110.109 -179.927 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.851 ' HB1' ' CG2' ' A' ' 34' ' ' THR . . . . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.378 0.609 . . . . 0.0 110.509 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.579 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.5 mt -142.93 134.3 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.364 -0.835 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.402 HG12 ' N ' ' A' ' 50' ' ' THR . 62.0 t -106.92 161.2 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.447 ' HB ' ' OG ' ' A' ' 32' ' ' SER . 22.4 m -145.82 160.15 42.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.296 -0.877 . . . . 0.0 109.885 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.2 134.85 38.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.178 -0.951 . . . . 0.0 110.266 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.24 128.35 43.08 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 110.423 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.445 ' OH ' ' CD2' ' A' ' 62' ' ' PHE . 61.5 m-85 -118.42 151.01 38.59 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.308 -0.87 . . . . 0.0 110.228 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -103.72 -16.67 15.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.217 -0.927 . . . . 0.0 110.341 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.3 m -128.61 131.53 48.13 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 0.0 110.125 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -57.44 -50.04 74.31 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.237 -0.915 . . . . 0.0 110.347 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.65 -43.71 69.02 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.187 -0.945 . . . . 0.0 110.429 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -57.79 -44.91 86.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.313 -0.867 . . . . 0.0 110.589 -179.302 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.429 ' HD2' HG23 ' A' ' 5' ' ' VAL . 4.9 ttt-85 -58.79 -40.45 84.06 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.041 -1.037 . . . . 0.0 110.039 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -61.42 -36.18 79.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.478 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 38.4 mt-30 -65.64 -44.85 85.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.297 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.64 ' O ' HG22 ' A' ' 66' ' ' VAL . 4.2 t80 -55.75 -46.16 77.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.279 -0.888 . . . . 0.0 110.598 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.44 -23.0 62.31 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.927 . . . . 0.0 110.747 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 59.9 p -93.01 -19.87 21.15 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.074 -1.017 . . . . 0.0 110.619 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 27.9 mt-30 -95.83 -8.6 33.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.154 -0.966 . . . . 0.0 110.173 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.738 ' O ' HG23 ' A' ' 66' ' ' VAL . 16.9 m -111.82 108.57 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 0.0 110.047 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -65.61 107.79 1.84 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 110.243 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.404 ' HA ' HD13 ' A' ' 68' ' ' ILE . 16.2 mm -88.96 128.36 52.33 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.218 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 1.078 ' CG ' HD12 ' A' ' 72' ' ' ILE . 43.4 Cg_endo -58.83 -155.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.948 1.499 . . . . 0.0 110.366 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' LYS . . . . . 0.521 ' O ' ' HD3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -111.02 40.76 1.96 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -0.972 . . . . 0.0 110.554 -179.729 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.74 -15.64 0.12 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.266 -0.896 . . . . 0.0 111.663 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 1.078 HD12 ' CG ' ' A' ' 69' ' ' PRO . 19.1 mt -94.95 103.44 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 120.693 -1.255 . . . . 0.0 110.037 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' THR . . . . . 0.429 HG22 ' N ' ' A' ' 74' ' ' VAL . 61.6 m -95.85 163.9 12.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.289 -0.882 . . . . 0.0 109.969 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.734 HG11 HG13 ' A' ' 5' ' ' VAL . 21.3 t -143.11 130.09 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.056 -1.028 . . . . 0.0 111.651 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 177.43 4.9 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.293 0.568 . . . . 0.0 110.089 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.406 ' O ' ' O ' ' B' ' 80' ' ' SER . 0.7 OUTLIER -111.84 152.97 27.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.176 -0.952 . . . . 0.0 110.252 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.865 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -158.87 168.7 35.04 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' B' ' 78' ' ' PHE . 70.9 m-85 -147.71 124.82 11.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.142 -1.211 . . . . 0.0 110.174 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.3 174.24 6.59 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.223 -0.923 . . . . 0.0 110.384 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.543 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -144.21 106.34 4.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.28 -0.888 . . . . 0.0 110.105 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.543 HG23 ' C ' ' A' ' 80' ' ' SER . 10.7 pt . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.266 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.185 0.517 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 2' ' ' THR . . . . . 0.436 ' O ' HG23 ' B' ' 4' ' ' ILE . 24.4 p -125.74 108.59 25.65 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.178 -0.951 . . . . 0.0 110.323 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -49.3 150.04 8.33 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.06 1.558 . . . . 0.0 110.533 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.876 HD11 ' HA3' ' B' ' 77' ' ' GLY . 1.0 OUTLIER -143.88 176.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 0.0 110.391 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.722 HG13 HG11 ' B' ' 74' ' ' VAL . 77.6 t -145.89 120.91 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.245 -0.909 . . . . 0.0 110.1 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.59 125.54 51.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.597 ' O ' HG23 ' B' ' 48' ' ' ILE . 3.1 mp -117.34 141.43 48.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.327 -0.858 . . . . 0.0 110.194 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.519 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 20.8 tptp -139.13 160.02 40.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.139 -0.976 . . . . 0.0 110.45 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.519 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 156.88 -156.6 27.31 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 10' ' ' ASP . . . . . 0.453 ' OD1' ' HB2' ' B' ' 12' ' ' ASN . 5.4 t70 -65.15 125.01 23.66 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.29 -1.124 . . . . 0.0 110.423 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.956 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.14 -36.8 31.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 110.47 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 12' ' ' ASN . . . . . 0.453 ' HB2' ' OD1' ' B' ' 10' ' ' ASP . 3.7 m-20 -68.35 -47.32 67.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.702 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.537 ' CG2' HD11 ' B' ' 72' ' ' ILE . 63.1 m -57.79 -23.04 50.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.151 -0.968 . . . . 0.0 110.247 -179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.956 HD12 ' HA ' ' B' ' 11' ' ' ALA . 53.9 mt -69.65 -32.11 70.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.289 -0.882 . . . . 0.0 110.285 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -59.72 -38.75 82.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.249 -0.907 . . . . 0.0 110.419 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.434 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 6.8 t -70.04 -36.64 75.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.927 . . . . 0.0 110.459 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.952 HD12 ' HA ' ' B' ' 14' ' ' LEU . 30.2 mt -58.59 -50.7 72.86 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.134 -0.978 . . . . 0.0 110.3 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.568 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 10.9 ttm180 -46.5 -27.13 1.01 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.401 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.463 ' CD1' ' C ' ' B' ' 19' ' ' TYR . 9.1 t80 -64.99 -42.35 94.59 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.188 -0.945 . . . . 0.0 110.694 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -71.58 -22.63 61.71 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.165 -0.959 . . . . 0.0 110.402 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.568 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 12.7 m-30 -66.44 -9.9 38.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.142 -0.974 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.67 -50.87 67.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.237 -0.914 . . . . 0.0 110.434 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -75.07 -14.66 60.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.201 -0.937 . . . . 0.0 110.235 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.759 ' CD2' HD12 ' B' ' 27' ' ' LEU . 2.4 m80 -94.92 19.75 9.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.973 . . . . 0.0 110.186 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 25.4 p -57.08 -25.07 58.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.452 HG22 ' H ' ' B' ' 26' ' ' THR . 3.4 t -96.84 3.37 52.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.265 -0.897 . . . . 0.0 110.001 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.759 HD12 ' CD2' ' B' ' 24' ' ' HIS . 23.9 mt -92.03 -32.61 15.13 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.288 -0.883 . . . . 0.0 110.501 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.493 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 50.6 p90 -117.64 167.17 11.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.004 -1.06 . . . . 0.0 110.129 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.9 m -100.07 -31.06 11.61 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 110.665 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 116.88 2.55 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.006 -1.059 . . . . 0.0 110.744 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.519 ' O ' HG13 ' B' ' 31' ' ' VAL . 3.1 p -89.1 112.88 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.182 -0.949 . . . . 0.0 110.073 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.532 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 91.1 p -66.43 142.95 57.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.367 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 1.5 p -61.32 162.11 8.19 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.809 ' CG2' ' HB1' ' B' ' 47' ' ' ALA . 89.6 m -68.0 134.81 51.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 110.207 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.597 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 41.1 p-90 -146.36 -179.15 6.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.913 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.614 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 46.0 t60 -162.53 174.41 12.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.128 -0.982 . . . . 0.0 110.427 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.614 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 88.1 m95 -78.65 104.94 9.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.336 -0.853 . . . . 0.0 110.294 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 44.5 m . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.431 -0.793 . . . . 0.0 109.943 -179.914 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.809 ' HB1' ' CG2' ' B' ' 34' ' ' THR . . . . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 121.363 0.601 . . . . 0.0 110.645 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.597 HG23 ' O ' ' B' ' 7' ' ' LEU . 45.4 mt -142.59 134.85 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.289 -0.882 . . . . 0.0 110.025 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.64 161.22 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.157 -0.964 . . . . 0.0 110.522 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.438 ' HB ' ' OG ' ' B' ' 32' ' ' SER . 23.6 m -145.88 160.32 41.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.805 . . . . 0.0 109.908 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.36 134.96 38.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.162 -0.962 . . . . 0.0 110.335 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 127.29 42.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.235 -0.915 . . . . 0.0 110.255 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' B' ' 62' ' ' PHE . 61.0 m-85 -117.11 150.81 38.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.349 -0.844 . . . . 0.0 109.982 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -103.49 -16.72 15.48 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 19.4 m -128.43 132.42 48.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.181 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -58.19 -49.89 75.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.885 . . . . 0.0 110.252 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.76 -43.52 69.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.342 -0.849 . . . . 0.0 110.527 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -57.85 -45.29 86.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.319 -0.863 . . . . 0.0 110.612 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.463 ' HD2' HG23 ' B' ' 5' ' ' VAL . 4.7 ttt-85 -58.83 -40.86 85.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.091 -1.005 . . . . 0.0 110.119 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -61.12 -35.79 77.99 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.862 . . . . 0.0 110.301 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.464 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 38.4 mt-30 -65.61 -45.21 84.0 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.243 -0.91 . . . . 0.0 110.391 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.66 ' O ' HG22 ' B' ' 66' ' ' VAL . 4.4 t80 -55.53 -46.2 77.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.314 -0.866 . . . . 0.0 110.703 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.57 -22.03 61.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.233 -0.917 . . . . 0.0 110.693 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 58.9 p -93.92 -19.82 20.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.247 -0.908 . . . . 0.0 110.574 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 65' ' ' GLN . . . . . 0.464 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 30.0 mt-30 -95.82 -9.58 31.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.21 -0.931 . . . . 0.0 110.066 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.73 HG23 ' O ' ' B' ' 66' ' ' VAL . 16.8 m -110.75 109.02 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.865 . . . . 0.0 110.155 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -66.31 107.96 2.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.347 -0.846 . . . . 0.0 110.266 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.437 ' O ' ' O ' ' B' ' 69' ' ' PRO . 17.1 mm -89.1 127.45 55.45 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.41 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 1.081 ' CG ' HD12 ' B' ' 72' ' ' ILE . 43.5 Cg_endo -57.46 -155.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 124.054 1.555 . . . . 0.0 110.442 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 70' ' ' LYS . . . . . 0.521 ' HD3' ' O ' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -112.15 40.84 2.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.025 -1.047 . . . . 0.0 110.458 -179.775 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.63 -15.7 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.295 -0.878 . . . . 0.0 111.616 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 1.081 HD12 ' CG ' ' B' ' 69' ' ' PRO . 20.7 mt -94.98 102.95 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 120.934 -1.104 . . . . 0.0 109.898 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 73' ' ' THR . . . . . 0.425 HG22 ' N ' ' B' ' 74' ' ' VAL . 66.0 m -95.45 163.71 13.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.883 . . . . 0.0 110.083 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.722 HG11 HG13 ' B' ' 5' ' ' VAL . 21.5 t -142.88 130.64 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.05 -1.031 . . . . 0.0 111.615 -178.593 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 75' ' ' SER . . . . . 0.429 ' HB3' HG22 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -101.97 178.7 4.54 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.144 179.62 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 76' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.7 OUTLIER -113.75 151.07 32.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 179.81 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.876 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -157.23 169.7 34.32 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' A' ' 78' ' ' PHE . 69.4 m-85 -147.85 126.57 12.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -1.153 . . . . 0.0 110.136 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.57 172.59 7.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.093 -1.005 . . . . 0.0 110.297 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.54 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.1 OUTLIER -142.48 107.06 4.82 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.897 . . . . 0.0 109.875 179.86 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.54 HG23 ' C ' ' B' ' 80' ' ' SER . 10.5 pt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.284 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.5 ' HB2' ' CE2' ' A' ' 78' ' ' PHE . 23.9 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 2' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 53' ' ' TYR . 52.1 m -128.04 133.17 24.84 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.294 -0.879 . . . . 0.0 109.913 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.517 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -81.5 161.7 19.51 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.925 1.487 . . . . 0.0 110.319 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.609 HG22 ' CG2' ' A' ' 52' ' ' THR . 6.5 pt -144.05 163.63 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.093 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.8 t -145.75 129.84 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.2 OUTLIER -105.37 137.0 43.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.267 -0.895 . . . . 0.0 110.374 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.671 HD21 ' HB ' ' A' ' 49' ' ' VAL . 3.4 pp -125.38 142.78 51.31 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.343 -0.848 . . . . 0.0 109.826 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.831 ' O ' HD13 ' A' ' 72' ' ' ILE . 21.6 tptt -136.18 154.82 50.84 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.054 -1.028 . . . . 0.0 110.833 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 161.89 -178.74 37.63 Favored Glycine 0 N--CA 1.486 1.985 0 N-CA-C 108.455 -1.858 . . . . 0.0 108.455 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.56 150.47 48.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.976 -1.308 . . . . 0.0 111.07 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.849 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.83 -52.18 43.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.143 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -48.82 -45.55 40.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.11 -0.994 . . . . 0.0 110.16 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.2 m -58.03 -20.89 42.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.33 -0.856 . . . . 0.0 110.203 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.849 HD12 ' HA ' ' A' ' 11' ' ' ALA . 16.5 mt -83.93 -32.32 25.15 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.235 -0.915 . . . . 0.0 110.302 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -60.91 -37.04 80.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.075 -1.016 . . . . 0.0 110.488 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -47.77 59.27 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.268 -0.895 . . . . 0.0 111.384 -179.054 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.0 mt -58.44 -52.38 65.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.072 -1.017 . . . . 0.0 110.539 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 -45.66 -33.94 3.2 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -64.73 -13.13 53.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.233 -0.917 . . . . 0.0 110.163 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.22 -33.2 10.53 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.244 -0.91 . . . . 0.0 110.241 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.561 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 8.7 m-30 -66.59 -33.63 76.1 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.48 -44.83 93.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 110.383 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -75.03 -32.63 61.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.187 -0.946 . . . . 0.0 110.249 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.606 ' O ' ' N ' ' A' ' 26' ' ' THR . 1.3 m-70 -95.78 34.65 1.48 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.322 -0.861 . . . . 0.0 110.34 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.601 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 13.2 p -59.6 43.53 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.435 -0.791 . . . . 0.0 112.011 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.606 ' N ' ' O ' ' A' ' 24' ' ' HIS . 75.3 p -144.72 33.29 1.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.768 -1.208 . . . . 0.0 109.663 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.405 ' HG ' ' C ' ' A' ' 26' ' ' THR . 78.6 mt -146.31 -5.79 0.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.183 -0.948 . . . . 0.0 111.448 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.601 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 10.5 p90 -126.13 162.38 25.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.686 -1.259 . . . . 0.0 108.912 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.495 ' HB ' ' O ' ' A' ' 52' ' ' THR . 6.6 m -101.81 -38.74 7.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.641 -1.287 . . . . 0.0 111.34 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.01 120.08 2.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.881 -1.137 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.652 ' O ' HG22 ' B' ' 38' ' ' THR . 3.2 p -88.97 105.65 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.281 -0.887 . . . . 0.0 109.893 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.608 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 54.7 p -64.35 152.87 40.14 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.528 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.46 155.56 21.49 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.278 -0.888 . . . . 0.0 110.109 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' THR . . . . . 0.58 ' HA ' HG22 ' A' ' 49' ' ' VAL . 31.9 m -68.05 129.18 39.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.223 -0.923 . . . . 0.0 110.546 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.604 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 50.5 p-90 -147.13 179.92 7.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.207 -0.933 . . . . 0.0 110.125 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.539 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 36.2 t-80 -162.57 173.27 14.19 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.977 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.539 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 98.1 m95 -79.07 126.0 30.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.13 -0.981 . . . . 0.0 109.928 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.416 HG22 ' O ' ' B' ' 31' ' ' VAL . 11.4 t . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.325 0.583 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.628 HG23 ' O ' ' A' ' 7' ' ' LEU . 68.7 mt -142.8 155.99 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.406 -0.809 . . . . 0.0 109.854 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.671 ' HB ' HD21 ' A' ' 7' ' ' LEU . 87.2 t -136.24 129.79 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.144 -0.972 . . . . 0.0 110.524 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.469 ' OG1' ' NE2' ' A' ' 6' ' ' HIS . 86.5 m -93.94 150.06 20.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.071 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.55 HD12 HD23 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -135.05 121.18 20.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.103 -0.998 . . . . 0.0 110.055 179.993 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.609 ' CG2' HG22 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -99.0 144.26 28.36 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 110.408 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.517 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 26.4 m-85 -124.08 156.73 36.07 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 109.839 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -83.67 -6.03 59.34 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.149 -0.97 . . . . 0.0 110.682 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.1 m -163.98 156.4 17.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.092 -1.005 . . . . 0.0 110.408 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 62.9 mt-10 -68.62 -41.25 79.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.258 -0.901 . . . . 0.0 110.28 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.412 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 6.0 t90 -53.64 -52.75 58.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.179 -0.95 . . . . 0.0 109.982 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.46 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 48.1 tt0 -58.98 -32.86 70.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.384 -0.823 . . . . 0.0 110.253 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 3.6 ttm180 -59.02 -54.52 46.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.302 -0.874 . . . . 0.0 110.621 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -61.04 -25.87 67.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.193 -0.942 . . . . 0.0 110.32 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.46 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 68.4 mt-30 -65.63 -54.36 28.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.159 -0.963 . . . . 0.0 110.308 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.9 ' CE2' HG21 ' A' ' 66' ' ' VAL . 7.2 t80 -55.76 -46.75 77.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.343 -0.848 . . . . 0.0 110.456 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.4 mt -59.14 -20.64 55.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.281 -0.887 . . . . 0.0 110.343 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.44 -22.54 19.56 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.904 . . . . 0.0 110.289 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -96.41 -21.56 17.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.2 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.9 HG21 ' CE2' ' A' ' 62' ' ' PHE . 59.9 t -97.55 105.55 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.47 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' LYS . . . . . 0.422 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.7 OUTLIER -58.26 103.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.899 179.664 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.581 HG23 ' CG2' ' A' ' 72' ' ' ILE . 40.6 mt -88.9 99.51 1.57 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 110.094 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HG2' HG12 ' A' ' 72' ' ' ILE . 46.8 Cg_endo -45.13 159.41 0.15 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.069 1.563 . . . . 0.0 110.36 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -63.82 -13.68 46.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.5 p -84.62 -21.11 30.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.268 -0.895 . . . . 0.0 110.195 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.831 HD13 ' O ' ' A' ' 8' ' ' LYS . 6.8 mm -94.24 113.47 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.0 110.183 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.5 m -94.35 145.06 25.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.252 -0.905 . . . . 0.0 110.174 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.51 171.8 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.204 -0.935 . . . . 0.0 110.921 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.596 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.6 OUTLIER -142.68 154.65 44.52 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.576 -0.703 . . . . 0.0 110.496 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 60.4 p -131.77 134.89 46.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.174 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.34 -170.7 34.2 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' B' ' 78' ' ' PHE . 0.0 OUTLIER -147.71 143.91 27.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.362 -1.081 . . . . 0.0 110.033 -179.934 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.2 mmm -135.89 155.42 50.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.779 -1.201 . . . . 0.0 110.649 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.81 108.56 5.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 0.0 110.065 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.3 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.216 -179.972 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.514 ' HB2' ' CE2' ' B' ' 78' ' ' PHE . 22.5 mtp . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.205 0.526 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 2' ' ' THR . . . . . 0.514 HG23 ' O ' ' B' ' 53' ' ' TYR . 58.8 m -127.31 133.84 25.51 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.382 -0.824 . . . . 0.0 110.154 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.51 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -82.19 161.2 17.82 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.918 1.483 . . . . 0.0 110.287 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.617 HG22 ' CG2' ' B' ' 52' ' ' THR . 6.4 pt -143.99 163.36 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.242 -0.911 . . . . 0.0 110.096 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -145.78 130.89 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.237 -0.915 . . . . 0.0 110.267 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.588 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.2 OUTLIER -106.1 138.91 41.45 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.244 -0.91 . . . . 0.0 110.349 -179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.654 HD21 ' HB ' ' B' ' 49' ' ' VAL . 3.5 pp -127.96 142.9 51.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.195 -0.941 . . . . 0.0 110.299 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.859 ' O ' HD13 ' B' ' 72' ' ' ILE . 24.1 tptt -140.21 163.17 33.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.118 -0.989 . . . . 0.0 110.526 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.509 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 166.16 -79.7 0.12 Allowed Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -173.28 150.7 1.92 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.252 -1.146 . . . . 0.0 109.509 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.653 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.39 -57.3 7.17 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 110.645 -179.091 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -50.65 -48.51 58.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.408 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 69.8 m -58.19 -21.99 49.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.171 -0.956 . . . . 0.0 110.484 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' B' ' 11' ' ' ALA . 16.3 mt -83.34 -32.83 26.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -0.977 . . . . 0.0 110.603 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 ttmt -60.81 -36.98 80.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.016 -1.053 . . . . 0.0 110.635 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -47.5 61.98 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.232 -0.917 . . . . 0.0 111.181 -179.191 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.3 mt -58.54 -52.7 64.53 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.104 -0.998 . . . . 0.0 110.664 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -45.28 -33.69 2.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.232 -0.917 . . . . 0.0 110.135 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -64.82 -13.64 56.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.269 -0.895 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.48 -33.4 10.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.169 -0.957 . . . . 0.0 110.172 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.1 m-30 -66.49 -33.91 76.74 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.23 -0.919 . . . . 0.0 110.355 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.42 -44.7 93.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.343 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 mmtm -74.97 -32.93 61.81 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.184 -0.947 . . . . 0.0 110.26 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.602 ' O ' ' N ' ' B' ' 26' ' ' THR . 1.3 m-70 -95.48 35.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.281 -0.887 . . . . 0.0 110.238 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.604 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.3 p -59.78 43.07 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.467 -0.771 . . . . 0.0 112.139 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.602 ' N ' ' O ' ' B' ' 24' ' ' HIS . 77.8 p -144.69 33.84 1.15 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.729 -1.232 . . . . 0.0 109.846 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.423 ' HG ' ' C ' ' B' ' 26' ' ' THR . 81.5 mt -146.5 -6.04 0.55 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.237 -0.914 . . . . 0.0 111.375 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 10.9 p90 -125.42 162.61 24.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.701 -1.249 . . . . 0.0 108.779 178.94 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' B' ' 52' ' ' THR . 6.9 m -101.77 -39.01 7.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.642 -1.286 . . . . 0.0 111.187 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.97 120.18 2.97 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.059 -1.025 . . . . 0.0 111.185 -179.523 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.565 ' O ' HG13 ' B' ' 31' ' ' VAL . 3.3 p -89.09 105.26 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.006 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.604 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.3 p -64.39 153.05 39.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.252 -0.905 . . . . 0.0 110.557 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.22 155.98 19.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.272 -0.892 . . . . 0.0 110.42 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 34' ' ' THR . . . . . 0.587 ' HA ' HG22 ' B' ' 49' ' ' VAL . 26.8 m -68.17 128.48 36.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.382 -0.824 . . . . 0.0 110.343 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.608 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 49.7 p-90 -146.94 179.51 7.54 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.536 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 36.4 t-80 -162.28 173.3 14.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.081 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.536 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 98.0 m95 -79.18 125.19 29.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 0.0 110.009 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 38' ' ' THR . . . . . 0.652 HG22 ' O ' ' A' ' 31' ' ' VAL . 11.3 t . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.234 -0.916 . . . . 0.0 110.157 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.255 0.55 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.589 HG23 ' O ' ' B' ' 7' ' ' LEU . 62.8 mt -143.1 156.13 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.32 -0.862 . . . . 0.0 109.987 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 49' ' ' VAL . . . . . 0.654 ' HB ' HD21 ' B' ' 7' ' ' LEU . 76.2 t -136.25 129.84 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 110.537 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.504 ' OG1' ' NE2' ' B' ' 6' ' ' HIS . 87.1 m -94.01 149.78 20.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.367 -0.833 . . . . 0.0 109.873 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.542 HD12 HD23 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -134.69 121.56 20.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.043 -1.036 . . . . 0.0 110.052 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.617 ' CG2' HG22 ' B' ' 4' ' ' ILE . 0.0 OUTLIER -99.22 144.57 28.2 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.313 -0.867 . . . . 0.0 110.607 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.514 ' O ' HG23 ' B' ' 2' ' ' THR . 26.0 m-85 -124.62 157.09 36.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.268 -0.895 . . . . 0.0 109.893 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -84.0 -6.99 59.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.264 -0.898 . . . . 0.0 110.664 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.57 157.81 22.57 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.101 -0.999 . . . . 0.0 110.354 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 56' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 57.9 mt-10 -70.16 -41.11 74.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.234 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 57' ' ' TRP . . . . . 0.409 ' O ' ' HG3' ' B' ' 61' ' ' GLN . 6.0 t90 -53.56 -52.55 59.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.093 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 46.5 tt0 -59.28 -32.55 70.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.855 . . . . 0.0 110.233 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 3.7 ttm180 -59.11 -54.38 47.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.228 -0.92 . . . . 0.0 110.448 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.15 -26.07 67.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.217 -0.927 . . . . 0.0 110.324 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 68.0 mt-30 -65.55 -54.28 30.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.207 -0.933 . . . . 0.0 110.229 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.893 ' CZ ' HG21 ' B' ' 66' ' ' VAL . 7.1 t80 -55.91 -46.69 78.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.318 -0.864 . . . . 0.0 110.518 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.4 mt -59.31 -20.71 56.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.55 -22.3 19.6 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.228 -0.92 . . . . 0.0 110.368 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -96.33 -22.0 17.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.22 -0.925 . . . . 0.0 110.023 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.893 HG21 ' CZ ' ' B' ' 62' ' ' PHE . 60.7 t -97.22 107.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.341 -0.849 . . . . 0.0 110.341 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.28 103.22 0.22 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -0.885 . . . . 0.0 109.855 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.613 HG23 ' CG2' ' B' ' 72' ' ' ILE . 40.1 mt -88.68 98.68 1.17 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.244 -0.91 . . . . 0.0 110.264 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.477 ' HG2' HG12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -43.99 159.45 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.998 1.525 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 20.9 mtmt -63.73 -13.84 47.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.22 -0.925 . . . . 0.0 110.263 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.3 p -84.64 -20.94 30.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 0.0 110.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.859 HD13 ' O ' ' B' ' 8' ' ' LYS . 6.8 mm -93.75 113.22 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 0.0 110.108 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.1 m -94.3 144.96 25.09 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.305 -0.872 . . . . 0.0 110.091 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.54 171.57 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 110.973 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 75' ' ' SER . . . . . 0.588 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -142.93 154.0 43.63 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.613 -0.68 . . . . 0.0 110.516 179.825 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 60.9 p -131.43 135.72 47.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.293 -0.88 . . . . 0.0 110.146 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.47 -170.89 34.54 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' A' ' 78' ' ' PHE . 0.0 OUTLIER -147.69 143.64 27.77 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.253 -1.145 . . . . 0.0 109.964 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.4 mmm -135.7 155.64 50.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.951 -1.093 . . . . 0.0 110.742 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -142.33 109.27 5.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.383 -0.823 . . . . 0.0 109.982 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.216 -179.907 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' A' ' 78' ' ' PHE . 3.5 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.297 0.57 . . . . 0.0 110.307 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.39 108.67 61.95 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.275 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.511 ' O ' ' HA ' ' A' ' 52' ' ' THR . 51.9 Cg_endo -68.68 143.3 55.84 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.019 1.536 . . . . 0.0 110.047 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.42 HG23 ' C ' ' A' ' 3' ' ' PRO . 3.0 pt -144.69 164.75 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.142 -0.974 . . . . 0.0 110.778 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.404 ' CG2' ' HB2' ' A' ' 51' ' ' LEU . 17.1 m -144.54 147.05 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.724 . . . . 0.0 109.497 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -105.71 127.91 53.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.047 -1.033 . . . . 0.0 110.687 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.948 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -116.78 136.0 53.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.536 ' HG3' ' CG1' ' A' ' 48' ' ' ILE . 13.4 ttmt -140.12 164.47 29.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.221 -0.924 . . . . 0.0 110.26 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 152.49 -174.95 31.29 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.89 136.9 57.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.25 -1.147 . . . . 0.0 110.088 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ALA . . . . . 0.778 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.97 -23.31 1.94 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 110.136 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -68.95 -59.84 2.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.22 -0.925 . . . . 0.0 110.304 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.438 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -57.96 -21.67 45.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.324 -0.86 . . . . 0.0 110.21 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.778 HD12 ' HA ' ' A' ' 11' ' ' ALA . 17.9 mt -66.8 -45.57 77.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.303 -0.873 . . . . 0.0 110.443 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -59.93 -31.26 69.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.186 -0.947 . . . . 0.0 110.373 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.513 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.1 t -69.94 -41.75 74.15 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.237 -0.914 . . . . 0.0 110.545 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 13' ' ' THR . 82.3 mt -58.96 -52.48 65.58 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.118 -0.989 . . . . 0.0 110.435 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 24.3 ttt-85 -48.89 -24.35 1.44 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.299 -0.875 . . . . 0.0 110.525 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 9.8 t80 -64.54 -40.67 96.03 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.106 -0.996 . . . . 0.0 110.282 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 mtm-85 -76.17 -15.53 60.04 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.173 -0.955 . . . . 0.0 110.029 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.586 ' CE2' HD21 ' A' ' 51' ' ' LEU . 3.7 m-30 -66.33 -30.9 71.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.251 -0.905 . . . . 0.0 109.836 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -63.31 -33.96 76.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -0.915 . . . . 0.0 109.883 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -74.89 -48.91 22.33 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.85 . . . . 0.0 109.732 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.573 ' HB3' HD22 ' A' ' 27' ' ' LEU . 54.4 m-70 -95.27 28.51 2.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.333 -0.855 . . . . 0.0 109.761 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.714 ' SG ' HG23 ' A' ' 26' ' ' THR . 22.6 p -56.75 -22.02 32.53 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 110.027 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.714 HG23 ' SG ' ' A' ' 25' ' ' CYS . 23.0 p -97.22 10.94 38.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -0.853 . . . . 0.0 109.949 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.573 HD22 ' HB3' ' A' ' 24' ' ' HIS . 0.7 OUTLIER -92.1 -43.37 9.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.0 110.175 179.903 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.632 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 19.8 p90 -96.41 175.72 6.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.1 -1.0 . . . . 0.0 109.965 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.441 ' OG1' ' HB2' ' A' ' 54' ' ' ASP . 88.7 m -101.27 -34.44 9.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.081 -1.012 . . . . 0.0 111.349 -179.285 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.65 118.88 2.52 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.953 -1.092 . . . . 0.0 110.969 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.506 HG13 ' CE1' ' A' ' 28' ' ' TYR . 7.4 m -89.39 100.0 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.973 -1.08 . . . . 0.0 109.623 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.584 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 58.0 p -47.55 144.34 3.17 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.302 -0.874 . . . . 0.0 110.771 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.1 p -61.86 164.92 5.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.228 -0.92 . . . . 0.0 109.948 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.9 m -68.03 120.5 14.36 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.117 -0.99 . . . . 0.0 110.142 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.516 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 32.7 p-90 -146.52 -174.02 4.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 109.64 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.559 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 28.2 t-80 -162.78 171.51 16.64 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.861 -1.149 . . . . 0.0 111.117 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.559 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 22.0 m95 -78.74 93.76 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.472 -0.767 . . . . 0.0 110.151 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.469 ' O ' ' O ' ' B' ' 31' ' ' VAL . 4.0 t . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.266 0.555 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.948 HG23 ' O ' ' A' ' 7' ' ' LEU . 63.3 mt -141.89 149.65 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.37 -0.831 . . . . 0.0 110.153 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 40.4 t -120.2 121.32 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.275 -0.891 . . . . 0.0 110.814 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.483 ' HB ' ' OG ' ' A' ' 32' ' ' SER . 33.2 m -93.73 148.95 21.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.329 -0.857 . . . . 0.0 109.131 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.586 HD21 ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -135.04 122.61 22.05 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.921 -1.112 . . . . 0.0 110.789 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 3' ' ' PRO . 26.1 m -98.12 144.26 27.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.547 -0.721 . . . . 0.0 109.416 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.504 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 55.2 m-85 -120.77 155.86 33.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.037 -1.039 . . . . 0.0 110.659 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ASP . . . . . 0.441 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 2.9 t70 -78.16 -9.39 59.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 110.832 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 56' ' ' GLU . 3.0 m -163.3 127.67 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.053 -1.029 . . . . 0.0 110.341 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -45.28 -41.76 8.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.218 -0.926 . . . . 0.0 109.834 179.666 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 57' ' ' TRP . . . . . 0.456 ' CE3' ' HA ' ' A' ' 57' ' ' TRP . 6.1 t-105 -54.05 -51.03 65.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.367 -0.833 . . . . 0.0 110.077 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.427 ' OE1' ' CA ' ' A' ' 58' ' ' GLN . 4.3 tp60 -58.35 -37.78 75.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.266 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.4 ttp85 -59.14 -44.31 92.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.194 -0.941 . . . . 0.0 110.674 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -36.85 80.9 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.158 -0.964 . . . . 0.0 110.16 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -65.68 -41.19 92.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.161 -0.962 . . . . 0.0 110.388 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.753 ' CZ ' HG11 ' A' ' 66' ' ' VAL . 23.5 t80 -55.96 -48.14 76.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.335 -0.853 . . . . 0.0 110.13 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 1.053 HD21 HG11 ' A' ' 74' ' ' VAL . 15.4 mt -59.09 -14.88 11.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.33 -0.857 . . . . 0.0 110.448 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.7 p -99.98 -21.46 15.64 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.7 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.539 HE22 HD21 ' A' ' 27' ' ' LEU . 31.6 mt-30 -94.13 -29.03 15.36 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.111 -0.993 . . . . 0.0 110.704 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.753 HG11 ' CZ ' ' A' ' 62' ' ' PHE . 5.5 m -89.79 172.89 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.126 -0.984 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.67 91.73 3.69 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.887 . . . . 0.0 109.459 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.821 HG21 HG21 ' A' ' 74' ' ' VAL . 29.7 mm -88.64 107.48 17.31 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.266 -0.896 . . . . 0.0 110.452 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.966 ' HG2' HD12 ' A' ' 72' ' ' ILE . 43.9 Cg_endo -54.66 -169.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.002 1.528 . . . . 0.0 110.231 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.65 -6.77 24.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.265 -0.897 . . . . 0.0 110.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -84.71 -23.81 29.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.351 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.966 HD12 ' HG2' ' A' ' 69' ' ' PRO . 3.5 mt -94.2 135.42 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.439 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.1 m -95.14 119.84 34.33 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.158 -0.964 . . . . 0.0 110.328 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 1.053 HG11 HD21 ' A' ' 63' ' ' LEU . 88.0 t -102.15 97.72 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.86 . . . . 0.0 109.562 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 59.0 m -102.53 172.12 7.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.568 -1.333 . . . . 0.0 110.698 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.3 p -111.96 177.28 4.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.333 -0.855 . . . . 0.0 109.747 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' GLY . . . . . 0.449 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -179.25 179.06 48.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.479 ' O ' ' O ' ' B' ' 78' ' ' PHE . 25.7 m-85 -147.75 136.87 22.23 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -1.1 . . . . 0.0 110.124 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.5 mtp -119.94 172.61 7.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.116 -0.99 . . . . 0.0 110.408 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.19 100.96 7.49 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.294 -0.879 . . . . 0.0 109.725 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.404 -179.472 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.483 ' HE2' ' HB3' ' B' ' 78' ' ' PHE . 3.2 mtp . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.175 0.512 . . . . 0.0 110.322 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 2' ' ' THR . . . . . 0.411 ' O ' HG23 ' B' ' 4' ' ' ILE . 0.7 OUTLIER -105.98 108.27 61.3 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.35 -0.844 . . . . 0.0 110.366 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.507 ' O ' ' HA ' ' B' ' 52' ' ' THR . 50.7 Cg_endo -67.87 143.26 60.26 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.917 1.483 . . . . 0.0 109.9 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.416 HG23 ' C ' ' B' ' 3' ' ' PRO . 2.8 pt -144.59 164.59 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.076 -1.015 . . . . 0.0 110.649 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.41 ' CG2' ' HB2' ' B' ' 51' ' ' LEU . 16.8 m -144.4 147.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.524 -0.735 . . . . 0.0 109.504 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -105.84 128.2 53.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.995 -1.066 . . . . 0.0 110.53 -179.524 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.926 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.2 OUTLIER -117.24 135.59 53.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.366 -0.834 . . . . 0.0 109.954 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.519 ' HG3' ' CG1' ' B' ' 48' ' ' ILE . 14.4 ttmt -139.78 164.35 30.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.211 -0.931 . . . . 0.0 110.11 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 152.66 -175.7 31.14 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.79 136.39 56.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.322 -1.105 . . . . 0.0 110.127 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 11' ' ' ALA . . . . . 0.783 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.15 -21.75 1.43 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.341 -0.849 . . . . 0.0 110.456 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -70.44 -58.99 3.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.203 -0.936 . . . . 0.0 110.024 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.425 ' O ' ' HG ' ' B' ' 17' ' ' LEU . 0.0 OUTLIER -58.1 -22.27 49.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.352 -0.843 . . . . 0.0 110.238 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.783 HD12 ' HA ' ' B' ' 11' ' ' ALA . 18.8 mt -66.75 -45.49 78.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.568 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.79 -31.13 69.4 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.153 -0.967 . . . . 0.0 110.325 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.513 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.1 t -70.28 -41.74 73.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.399 -0.813 . . . . 0.0 110.682 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' B' ' 13' ' ' THR . 83.2 mt -58.88 -52.69 64.65 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.018 -1.051 . . . . 0.0 110.333 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 18' ' ' ARG . . . . . 0.511 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 23.0 ttt-85 -48.68 -24.16 1.28 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 9.8 t80 -64.68 -40.62 95.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.025 -1.047 . . . . 0.0 110.316 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 69.9 mtm-85 -76.28 -14.82 60.1 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.226 -0.921 . . . . 0.0 110.038 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.601 ' CE2' HD21 ' B' ' 51' ' ' LEU . 3.7 m-30 -66.57 -31.09 71.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.24 -0.913 . . . . 0.0 109.85 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -63.38 -33.89 76.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.373 -0.829 . . . . 0.0 110.169 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -74.85 -49.06 21.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.677 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.577 ' HB3' HD22 ' B' ' 27' ' ' LEU . 20.2 m80 -94.9 28.79 2.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.378 -0.826 . . . . 0.0 109.748 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.731 ' SG ' HG23 ' B' ' 26' ' ' THR . 21.2 p -57.07 -21.8 34.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.759 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.731 HG23 ' SG ' ' B' ' 25' ' ' CYS . 23.6 p -97.27 10.78 38.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 110.073 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.577 HD22 ' HB3' ' B' ' 24' ' ' HIS . 0.7 OUTLIER -92.16 -44.09 8.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.244 -0.91 . . . . 0.0 110.377 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.636 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 20.8 p90 -95.82 175.44 6.51 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.095 -1.003 . . . . 0.0 109.837 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.436 ' OG1' ' HB2' ' B' ' 54' ' ' ASP . 80.7 m -100.95 -33.69 10.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.108 -0.995 . . . . 0.0 111.429 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.75 118.82 2.48 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.049 -1.032 . . . . 0.0 110.972 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.533 HG13 ' CE1' ' B' ' 28' ' ' TYR . 8.1 m -89.43 99.84 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.649 179.074 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.516 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.2 p -47.24 143.18 3.43 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.317 -0.865 . . . . 0.0 110.776 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 14.1 p -61.62 164.48 5.94 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.907 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 65.8 m -68.04 121.02 15.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.114 -0.991 . . . . 0.0 110.345 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.584 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 31.2 p-90 -146.74 -173.43 4.21 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.341 -0.85 . . . . 0.0 109.539 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.549 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 74.0 t60 -162.89 171.25 16.91 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.852 -1.155 . . . . 0.0 110.917 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.549 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 26.9 m95 -78.79 93.63 5.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.504 -0.748 . . . . 0.0 110.045 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 38' ' ' THR . . . . . 0.412 ' CG2' ' HD2' ' B' ' 36' ' ' HIS . 3.9 t . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.93 . . . . 0.0 110.438 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 121.35 0.595 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.926 HG23 ' O ' ' B' ' 7' ' ' LEU . 56.0 mt -141.87 150.29 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.171 -0.955 . . . . 0.0 110.098 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 41.3 t -121.11 121.17 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.233 -0.917 . . . . 0.0 110.731 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.471 ' HB ' ' OG ' ' B' ' 32' ' ' SER . 40.7 m -93.89 148.85 21.75 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.292 -0.88 . . . . 0.0 109.17 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 51' ' ' LEU . . . . . 0.601 HD21 ' CE2' ' B' ' 21' ' ' PHE . 0.4 OUTLIER -134.93 123.17 22.98 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.942 -1.099 . . . . 0.0 111.048 -179.417 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' B' ' 3' ' ' PRO . 24.1 m -98.19 143.81 28.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.515 -0.741 . . . . 0.0 109.61 179.042 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.505 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -120.52 155.31 33.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.066 -1.021 . . . . 0.0 110.552 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 54' ' ' ASP . . . . . 0.436 ' HB2' ' OG1' ' B' ' 29' ' ' THR . 3.0 t70 -77.69 -9.14 58.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.301 -0.874 . . . . 0.0 110.761 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.2 m -163.28 128.06 3.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.128 -0.983 . . . . 0.0 110.493 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -41.54 10.58 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.345 -0.847 . . . . 0.0 109.794 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 57' ' ' TRP . . . . . 0.447 ' HA ' ' CE3' ' B' ' 57' ' ' TRP . 6.0 t-105 -54.26 -51.22 65.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.318 -0.864 . . . . 0.0 110.027 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.44 ' CA ' ' OE1' ' B' ' 58' ' ' GLN . 4.1 tp60 -58.21 -37.25 74.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.16 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 40.0 ttp85 -59.32 -44.84 92.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.091 -1.006 . . . . 0.0 110.609 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -36.87 80.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.157 -0.964 . . . . 0.0 110.286 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -65.74 -41.08 92.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.292 -0.88 . . . . 0.0 110.29 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.786 ' CZ ' HG11 ' B' ' 66' ' ' VAL . 21.5 t80 -56.11 -48.28 76.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 0.0 110.223 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 1.057 HD21 HG11 ' B' ' 74' ' ' VAL . 15.0 mt -59.04 -14.2 8.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.357 -0.839 . . . . 0.0 110.277 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 17.8 p -100.54 -21.91 15.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.249 -0.907 . . . . 0.0 110.842 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 65' ' ' GLN . . . . . 0.542 HE22 HD21 ' B' ' 27' ' ' LEU . 30.3 mt-30 -94.09 -28.67 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.026 -1.046 . . . . 0.0 110.596 -178.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.786 HG11 ' CZ ' ' B' ' 62' ' ' PHE . 5.5 m -89.57 173.13 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.033 -1.042 . . . . 0.0 110.028 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.14 92.63 3.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.219 -0.926 . . . . 0.0 109.28 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.803 HG21 HG21 ' B' ' 74' ' ' VAL . 30.2 mm -88.99 107.23 16.39 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.366 -0.834 . . . . 0.0 110.438 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.96 ' HG2' HD12 ' B' ' 72' ' ' ILE . 44.8 Cg_endo -54.18 -168.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 124.034 1.544 . . . . 0.0 110.145 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.17 -6.52 24.17 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.138 -0.976 . . . . 0.0 110.411 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 47.8 p -84.84 -23.54 29.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.268 -0.895 . . . . 0.0 110.382 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.96 HD12 ' HG2' ' B' ' 69' ' ' PRO . 3.5 mt -94.15 135.23 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.258 -0.901 . . . . 0.0 110.416 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 39.7 m -95.22 119.87 34.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.174 -0.954 . . . . 0.0 110.217 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 1.057 HG11 HD21 ' B' ' 63' ' ' LEU . 88.6 t -101.81 97.69 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.171 -0.956 . . . . 0.0 109.42 177.599 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 58.2 m -102.47 172.2 7.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.476 -1.39 . . . . 0.0 110.628 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 72.8 p -112.53 176.34 5.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.401 -0.812 . . . . 0.0 109.823 179.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 77' ' ' GLY . . . . . 0.434 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -178.45 179.44 48.64 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.483 ' HB3' ' HE2' ' B' ' 1' ' ' MET . 26.7 m-85 -147.57 137.35 22.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -1.149 . . . . 0.0 110.194 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.6 mtp -120.11 172.64 7.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.129 -0.982 . . . . 0.0 110.338 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.78 100.97 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.305 -0.872 . . . . 0.0 109.73 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.191 -179.542 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' MET . . . . . 0.441 ' HE2' ' CD2' ' A' ' 78' ' ' PHE . 69.1 mtp . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.188 0.518 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.5 p -143.97 144.99 28.54 Favored Pre-proline 0 N--CA 1.491 1.577 0 O-C-N 121.253 -0.905 . . . . 0.0 110.272 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.489 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 51.7 Cg_endo -94.16 155.93 2.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.047 1.551 . . . . 0.0 110.062 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ILE . . . . . 0.525 HD13 ' HG3' ' A' ' 79' ' ' MET . 11.4 pt -144.32 166.55 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.136 -0.977 . . . . 0.0 110.563 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.684 HG13 HG21 ' A' ' 74' ' ' VAL . 24.4 t -145.72 124.14 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.378 -0.827 . . . . 0.0 110.017 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.501 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.69 110.57 22.92 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 110.274 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.956 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.7 tp -112.97 150.59 31.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.201 -0.937 . . . . 0.0 110.258 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.747 ' O ' HG23 ' A' ' 72' ' ' ILE . 8.5 ttpp -142.33 170.43 15.72 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.51 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.473 ' O ' HD11 ' A' ' 14' ' ' LEU . . . 151.24 -179.87 27.54 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -65.04 137.12 57.5 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.276 -1.132 . . . . 0.0 110.217 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.32 -31.44 14.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.31 -0.869 . . . . 0.0 110.629 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -71.14 -55.1 8.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.224 -0.922 . . . . 0.0 110.765 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.1 m -57.85 -20.46 36.56 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.189 -0.945 . . . . 0.0 110.398 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' LEU . . . . . 0.473 HD11 ' O ' ' A' ' 9' ' ' GLY . 20.9 mt -90.34 -25.05 20.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.309 -0.87 . . . . 0.0 110.083 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.4 mmtp -58.88 -42.62 89.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.345 -0.847 . . . . 0.0 110.294 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 19.0 t -69.8 -34.5 73.8 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.425 -0.797 . . . . 0.0 110.435 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 19' ' ' TYR . 5.3 mp -58.85 -53.59 56.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.35 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -44.87 -22.97 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.8 -179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.455 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 85.7 t80 -64.57 -42.91 95.33 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.101 -0.999 . . . . 0.0 109.877 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -62.6 -27.44 69.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.864 . . . . 0.0 109.969 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.526 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.6 -16.86 64.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.375 -0.828 . . . . 0.0 110.264 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -63.44 -56.11 18.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 109.804 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.457 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.27 -24.76 57.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.399 -0.813 . . . . 0.0 109.834 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.64 ' CA ' HD13 ' A' ' 27' ' ' LEU . 19.5 m170 -94.97 33.21 1.53 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.397 -0.815 . . . . 0.0 110.015 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 23.0 p -57.28 -23.79 50.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.349 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 26' ' ' THR . 2.7 t -97.28 13.52 29.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.194 -0.941 . . . . 0.0 110.687 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' CA ' ' A' ' 24' ' ' HIS . 3.3 mp -92.31 -26.54 18.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -0.983 . . . . 0.0 110.32 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.499 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 34.8 p90 -118.39 167.89 11.14 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -0.988 . . . . 0.0 110.034 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.494 ' N ' ' O ' ' A' ' 52' ' ' THR . 3.6 m -100.01 -34.24 10.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.127 -0.983 . . . . 0.0 110.457 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.569 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.62 117.06 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.926 . . . . 0.0 110.636 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.641 HG13 ' O ' ' B' ' 38' ' ' THR . 14.8 p -90.21 129.74 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.113 -0.992 . . . . 0.0 109.919 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.683 ' O ' HG13 ' A' ' 49' ' ' VAL . 2.0 t -87.4 148.1 25.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.235 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 p -61.18 167.31 3.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.21 -0.931 . . . . 0.0 110.45 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.02 121.07 15.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.281 -0.887 . . . . 0.0 110.538 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.457 ' O ' ' N ' ' A' ' 48' ' ' ILE . 36.8 p-90 -146.93 175.47 10.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.247 -0.908 . . . . 0.0 109.847 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 47' ' ' ALA . 31.6 p80 -162.57 173.39 14.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.07 -1.019 . . . . 0.0 110.702 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.403 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 92.2 m95 -79.66 125.35 29.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.531 -0.73 . . . . 0.0 110.106 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' THR . . . . . 0.515 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.5 t . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.076 -1.015 . . . . 0.0 110.269 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.373 0.606 . . . . 0.0 110.679 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.956 HG23 ' O ' ' A' ' 7' ' ' LEU . 46.3 mt -141.98 131.42 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.187 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' VAL . . . . . 0.683 HG13 ' O ' ' A' ' 32' ' ' SER . 4.3 t -118.34 125.89 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.243 -0.911 . . . . 0.0 110.189 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.479 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 88.0 m -93.82 157.43 16.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.221 -0.924 . . . . 0.0 110.094 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.6 mt -134.84 128.21 32.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.179 -0.951 . . . . 0.0 110.07 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.569 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 28.4 p -97.12 131.6 43.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.503 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 48.6 m-85 -112.52 150.21 31.6 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.185 -0.947 . . . . 0.0 110.218 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -74.96 -7.65 54.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.221 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.8 p -170.74 157.94 5.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.27 -0.894 . . . . 0.0 110.197 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.54 -37.64 88.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.325 -0.859 . . . . 0.0 110.354 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -54.03 -53.59 50.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.155 -0.965 . . . . 0.0 110.324 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -58.22 -35.46 71.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.299 -0.875 . . . . 0.0 110.44 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ARG . . . . . 0.808 ' NH2' HG23 ' A' ' 76' ' ' THR . 22.4 ttt180 -58.91 -42.55 89.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.047 -1.033 . . . . 0.0 109.963 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -34.8 76.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -65.62 -45.5 82.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.185 -0.947 . . . . 0.0 110.466 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.678 ' O ' HG13 ' A' ' 66' ' ' VAL . 3.0 t80 -55.96 -49.47 73.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.279 -0.888 . . . . 0.0 110.826 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.572 ' HA ' HG22 ' A' ' 66' ' ' VAL . 97.6 mt -59.28 -46.06 89.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.266 -0.896 . . . . 0.0 110.765 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.1 -20.59 66.54 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.129 -0.982 . . . . 0.0 110.417 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -95.81 -17.39 21.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.91 . . . . 0.0 110.42 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.727 ' O ' HG23 ' A' ' 66' ' ' VAL . 10.9 m -108.66 113.44 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -0.939 . . . . 0.0 110.409 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 115.62 9.9 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 110.064 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.639 HD11 HD11 ' A' ' 7' ' ' LEU . 4.2 tp -88.31 142.62 31.67 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.194 -0.941 . . . . 0.0 110.207 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.601 ' CG ' HD12 ' A' ' 72' ' ' ILE . 47.8 Cg_endo -94.72 162.4 1.81 Allowed 'Trans proline' 0 C--N 1.305 -1.762 0 O-C-N 124.034 1.544 . . . . 0.0 110.464 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -65.35 -16.76 63.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.227 -0.921 . . . . 0.0 110.347 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.3 m -84.68 -31.42 24.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 110.576 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.747 HG23 ' O ' ' A' ' 8' ' ' LYS . 75.6 mt -93.51 148.94 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.096 -1.003 . . . . 0.0 110.641 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 87.7 m -145.52 154.15 41.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.399 -0.813 . . . . 0.0 109.994 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.691 ' HB ' HD12 ' A' ' 7' ' ' LEU . 6.0 p -147.12 162.81 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.108 -0.995 . . . . 0.0 110.647 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' SER . . . . . 0.452 ' N ' HG22 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -139.25 -179.63 5.98 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.439 -0.788 . . . . 0.0 109.997 -179.817 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.808 HG23 ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -108.08 167.72 9.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.159 -0.963 . . . . 0.0 110.354 -179.813 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.79 177.71 43.1 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' PHE . . . . . 0.441 ' CD2' ' HE2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.81 135.86 21.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.37 -1.077 . . . . 0.0 110.114 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.525 ' HG3' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -117.87 153.86 32.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.253 -0.904 . . . . 0.0 110.269 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.8 p -125.35 100.73 6.64 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.285 -0.884 . . . . 0.0 110.176 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.4 tt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.19 -179.966 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 1' ' ' MET . . . . . 0.425 ' SD ' ' CE2' ' B' ' 78' ' ' PHE . 71.3 mtp . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.164 0.507 . . . . 0.0 110.081 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 29.2 p -145.34 143.39 20.09 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.17 -0.956 . . . . 0.0 110.343 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.491 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.8 Cg_endo -92.49 155.9 3.0 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.068 1.562 . . . . 0.0 110.214 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.476 HD13 ' HG3' ' B' ' 79' ' ' MET . 11.2 pt -144.23 166.36 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 110.501 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.685 HG13 HG21 ' B' ' 74' ' ' VAL . 24.5 t -145.77 124.07 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.264 -0.898 . . . . 0.0 110.03 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.503 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.0 OUTLIER -105.59 111.11 23.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 110.343 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.952 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.8 tp -113.32 150.13 32.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 110.138 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.738 ' O ' HG23 ' B' ' 72' ' ' ILE . 8.5 ttpp -142.04 169.98 16.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.278 -0.889 . . . . 0.0 110.312 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.472 ' O ' HD11 ' B' ' 14' ' ' LEU . . . 151.96 -179.98 28.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -65.07 137.85 57.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.204 -1.174 . . . . 0.0 110.199 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.43 -31.9 16.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.262 -0.899 . . . . 0.0 110.573 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.92 -55.16 9.01 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.273 -0.892 . . . . 0.0 110.846 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.404 ' O ' HD13 ' B' ' 17' ' ' LEU . 5.3 m -57.5 -20.96 34.7 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.179 -0.951 . . . . 0.0 110.391 -179.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 14' ' ' LEU . . . . . 0.472 HD11 ' O ' ' B' ' 9' ' ' GLY . 19.3 mt -90.15 -24.8 20.96 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp -58.91 -42.68 90.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.338 -0.851 . . . . 0.0 110.251 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.466 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.8 t -69.6 -34.98 74.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.417 -0.802 . . . . 0.0 110.36 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.404 HD13 ' O ' ' B' ' 13' ' ' THR . 5.5 mp -58.69 -53.64 56.13 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.343 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.2 ttp85 -44.59 -23.44 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.217 -0.927 . . . . 0.0 110.728 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.466 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 85.8 t80 -64.51 -43.43 94.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.022 -1.049 . . . . 0.0 109.852 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 7.8 mtp85 -61.97 -27.51 68.9 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.391 -0.818 . . . . 0.0 109.987 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.56 -16.99 64.57 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.283 -0.886 . . . . 0.0 110.268 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -63.47 -56.07 19.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.0 109.806 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 23' ' ' LYS . . . . . 0.451 ' N ' ' HD3' ' B' ' 23' ' ' LYS . 0.0 OUTLIER -75.07 -24.91 58.27 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 109.875 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.65 ' CA ' HD13 ' B' ' 27' ' ' LEU . 18.7 m170 -94.93 32.89 1.57 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.413 -0.805 . . . . 0.0 110.106 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.528 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 24.8 p -57.19 -23.6 48.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 0.0 110.395 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 26' ' ' THR . . . . . 0.42 HG22 ' H ' ' B' ' 26' ' ' THR . 2.7 t -97.26 13.42 29.53 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 110.674 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.65 HD13 ' CA ' ' B' ' 24' ' ' HIS . 3.2 mp -92.35 -26.39 18.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.528 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 33.9 p90 -118.36 167.97 11.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.11 -0.994 . . . . 0.0 109.979 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.489 ' N ' ' O ' ' B' ' 52' ' ' THR . 3.7 m -100.29 -34.23 10.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.203 -0.936 . . . . 0.0 110.492 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 30' ' ' ALA . . . . . 0.558 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.52 116.37 2.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.21 -0.931 . . . . 0.0 110.624 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.515 HG13 ' O ' ' A' ' 38' ' ' THR . 14.5 p -90.02 129.89 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 110.005 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.693 ' O ' HG13 ' B' ' 49' ' ' VAL . 2.1 t -87.54 148.41 24.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.41 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.5 p -61.07 166.99 3.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.413 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.99 120.77 14.79 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.287 -0.883 . . . . 0.0 110.423 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.479 ' CE3' ' OG ' ' A' ' 32' ' ' SER . 37.2 p-90 -146.58 175.26 10.72 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.224 -0.922 . . . . 0.0 109.932 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.509 ' HB3' ' HA ' ' B' ' 47' ' ' ALA . 31.4 p80 -162.5 172.97 14.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.092 -1.005 . . . . 0.0 110.724 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.429 ' CH2' HG23 ' A' ' 52' ' ' THR . 92.7 m95 -79.45 124.57 28.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.502 -0.749 . . . . 0.0 110.078 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 38' ' ' THR . . . . . 0.641 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.0 t . . . . . 0 N--CA 1.492 1.653 0 O-C-N 121.256 -0.902 . . . . 0.0 110.318 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.509 ' HA ' ' HB3' ' B' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 121.243 0.544 . . . . 0.0 110.657 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.952 HG23 ' O ' ' B' ' 7' ' ' LEU . 46.7 mt -142.06 130.31 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.376 -0.828 . . . . 0.0 110.101 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 49' ' ' VAL . . . . . 0.693 HG13 ' O ' ' B' ' 32' ' ' SER . 4.2 t -117.34 125.96 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.884 . . . . 0.0 110.177 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 88.0 m -93.79 157.5 16.11 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 mt -135.09 128.36 32.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 110.286 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.558 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 30.7 p -97.22 132.2 43.21 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.279 -0.888 . . . . 0.0 110.276 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' B' ' 53' ' ' TYR . 49.0 m-85 -113.01 150.36 32.04 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.288 -0.882 . . . . 0.0 110.021 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -75.13 -7.22 53.17 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.895 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 24.9 p -170.72 157.72 5.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.317 -0.864 . . . . 0.0 110.283 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.46 -38.21 90.24 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.265 -0.897 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 8.5 t-105 -53.83 -53.72 48.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.363 -0.836 . . . . 0.0 110.447 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -57.74 -35.43 70.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.473 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 59' ' ' ARG . . . . . 0.804 ' NH2' HG23 ' B' ' 76' ' ' THR . 23.3 ttt180 -58.94 -42.81 90.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.075 -1.016 . . . . 0.0 110.123 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.41 -34.48 75.45 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.322 -0.861 . . . . 0.0 110.333 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -65.77 -45.26 83.16 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.248 -0.908 . . . . 0.0 110.393 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.652 ' O ' HG13 ' B' ' 66' ' ' VAL . 3.2 t80 -56.1 -49.66 73.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.281 -0.887 . . . . 0.0 110.763 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.567 ' HA ' HG22 ' B' ' 66' ' ' VAL . 97.5 mt -59.22 -46.15 89.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.192 -0.942 . . . . 0.0 110.746 -179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.18 -20.7 66.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.204 -0.935 . . . . 0.0 110.436 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -95.7 -17.95 20.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.275 -0.89 . . . . 0.0 110.392 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.718 HG23 ' O ' ' B' ' 66' ' ' VAL . 12.4 m -107.87 114.22 45.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.244 -0.91 . . . . 0.0 110.328 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.41 115.94 11.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.045 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.637 HD11 HD11 ' B' ' 7' ' ' LEU . 4.1 tp -88.07 143.65 33.33 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.198 -0.939 . . . . 0.0 110.264 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.587 ' CG ' HD12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -95.71 161.83 1.45 Allowed 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.059 1.557 . . . . 0.0 110.344 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -65.23 -16.3 63.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.302 -0.874 . . . . 0.0 110.251 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 40.7 m -84.88 -31.35 23.77 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.256 -0.903 . . . . 0.0 110.463 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.738 HG23 ' O ' ' B' ' 8' ' ' LYS . 70.4 mt -93.65 148.83 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.157 -0.964 . . . . 0.0 110.599 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 90.9 m -145.5 154.14 41.89 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.354 -0.842 . . . . 0.0 110.028 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.685 HG21 HG13 ' B' ' 5' ' ' VAL . 6.1 p -147.22 162.81 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.112 -0.992 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 75' ' ' SER . . . . . 0.45 ' N ' HG22 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -139.16 -179.86 6.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.375 -0.828 . . . . 0.0 109.955 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 76' ' ' THR . . . . . 0.804 HG23 ' NH2' ' B' ' 59' ' ' ARG . 0.2 OUTLIER -107.72 167.47 9.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 0.0 110.435 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.24 177.5 42.88 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 78' ' ' PHE . . . . . 0.425 ' CE2' ' SD ' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.73 135.95 21.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.26 -1.141 . . . . 0.0 110.111 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.476 ' HG3' HD13 ' B' ' 4' ' ' ILE . 0.2 OUTLIER -117.94 154.24 32.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 110.281 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.5 p -125.5 100.69 6.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 110.132 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.25 -179.918 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtp . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.279 0.562 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.37 160.46 25.96 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.863 . . . . 0.0 109.989 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' PRO . . . . . 0.51 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 51.8 Cg_endo -114.82 159.16 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 123.885 1.466 . . . . 0.0 110.09 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 pt -144.49 164.37 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 110.221 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.443 HG21 ' CE1' ' A' ' 53' ' ' TYR . 97.8 t -145.94 127.64 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' HIS . . . . . 0.488 ' HB2' ' CE ' ' B' ' 79' ' ' MET . 0.0 OUTLIER -105.63 115.81 30.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.0 110.473 -179.673 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.912 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.6 OUTLIER -118.53 149.76 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.382 -0.824 . . . . 0.0 109.909 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.721 ' O ' HG23 ' A' ' 72' ' ' ILE . 7.4 ttpt -142.72 171.89 13.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.043 -1.036 . . . . 0.0 110.637 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLY . . . . . 0.466 ' HA3' HG12 ' A' ' 72' ' ' ILE . . . 151.51 173.86 21.75 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -64.99 138.23 58.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.16 -1.2 . . . . 0.0 110.056 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.29 -25.56 3.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.25 -0.906 . . . . 0.0 110.691 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' A' ' 15' ' ' LYS . 25.9 t30 -65.55 -61.36 2.14 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.961 . . . . 0.0 110.598 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' THR . . . . . 0.534 ' HB ' HD11 ' A' ' 72' ' ' ILE . 0.2 OUTLIER -57.87 -32.47 67.71 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.101 -0.999 . . . . 0.0 110.338 -179.769 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -67.75 -30.29 69.72 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 0.0 110.01 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 10.0 mmtp -59.99 -45.61 92.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.216 -0.928 . . . . 0.0 110.149 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.531 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 5.7 t -70.08 -36.56 75.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.472 -0.767 . . . . 0.0 110.739 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.9 -56.69 19.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.899 -1.125 . . . . 0.0 110.668 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -47.08 -21.33 0.22 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.676 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.531 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 91.0 t80 -64.27 -27.25 68.91 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.006 -1.059 . . . . 0.0 109.818 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 -79.6 -31.9 41.8 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.264 -0.898 . . . . 0.0 109.882 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 8.8 m-30 -66.33 -14.93 62.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -0.863 . . . . 0.0 110.101 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -63.43 -55.67 22.38 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.494 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 1.8 mptt -75.18 -22.7 57.84 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' HIS . . . . . 0.664 ' HB3' HD22 ' A' ' 27' ' ' LEU . 1.8 m-70 -95.04 38.93 1.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.264 -0.897 . . . . 0.0 110.172 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' CYS . . . . . 0.516 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 25.1 p -57.0 -25.43 58.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.358 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.8 t -97.49 11.34 37.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.268 -0.895 . . . . 0.0 110.76 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.664 HD22 ' HB3' ' A' ' 24' ' ' HIS . 3.0 mp -92.33 -32.41 15.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.083 -1.011 . . . . 0.0 110.355 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' TYR . . . . . 0.516 ' CE1' ' HA ' ' A' ' 25' ' ' CYS . 50.6 p90 -113.38 171.74 7.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.189 -0.945 . . . . 0.0 109.615 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.48 ' HB ' ' O ' ' A' ' 52' ' ' THR . 61.7 m -101.16 -36.22 9.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.056 -1.028 . . . . 0.0 111.064 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.4 122.54 3.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.023 -1.048 . . . . 0.0 110.798 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.683 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.0 p -88.16 108.16 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.162 -0.961 . . . . 0.0 109.891 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . 0.54 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -63.46 146.55 53.4 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.423 -0.798 . . . . 0.0 110.99 -179.403 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . 0.443 ' HB3' ' CG2' ' B' ' 38' ' ' THR . 36.3 p -61.58 163.41 7.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.403 -0.811 . . . . 0.0 110.258 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 115.62 7.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.321 -0.862 . . . . 0.0 110.647 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CB ' ' HB3' ' B' ' 35' ' ' TRP . 16.5 p-90 -146.92 168.66 20.92 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.267 -0.896 . . . . 0.0 110.091 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.546 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 14.2 p-80 -162.47 178.48 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' TRP . . . . . 0.633 ' CH2' HG23 ' B' ' 52' ' ' THR . 80.4 m95 -79.73 125.18 29.33 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.551 -0.718 . . . . 0.0 110.467 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 t . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.918 . . . . 0.0 110.271 179.832 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ALA . . . . . 0.48 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.228 0.537 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ILE . . . . . 0.912 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.7 mt -140.83 131.34 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.271 -0.893 . . . . 0.0 110.262 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 52.9 t -110.48 117.18 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.308 -0.87 . . . . 0.0 110.691 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.41 ' O ' ' HB3' ' A' ' 32' ' ' SER . 96.2 m -94.14 153.81 17.91 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.21 -0.931 . . . . 0.0 109.626 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.8 mp -136.31 131.2 34.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.931 -1.106 . . . . 0.0 110.497 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.664 HG23 ' CH2' ' B' ' 37' ' ' TRP . 7.6 p -97.34 135.07 39.77 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.394 -0.816 . . . . 0.0 110.042 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 3' ' ' PRO . 88.8 m-85 -111.23 148.75 32.16 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.136 -0.978 . . . . 0.0 110.396 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -81.97 -8.79 59.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.213 -0.93 . . . . 0.0 110.151 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.94 138.45 6.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.334 -0.854 . . . . 0.0 110.196 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -54.79 -39.2 68.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.252 -0.905 . . . . 0.0 110.266 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.77 -51.74 62.45 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 51.3 tt0 -57.12 -40.79 77.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.359 -0.838 . . . . 0.0 110.743 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -59.18 -36.87 76.1 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.036 -1.04 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.08 -44.5 97.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.947 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLN . . . . . 0.507 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 47.8 mt-30 -65.61 -39.0 91.06 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.124 -0.985 . . . . 0.0 110.619 -179.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' PHE . . . . . 0.648 ' O ' HG22 ' A' ' 66' ' ' VAL . 3.0 t80 -54.85 -48.21 73.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.163 -0.961 . . . . 0.0 110.221 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -59.8 -25.95 65.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.191 -0.943 . . . . 0.0 110.163 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.78 -20.41 42.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.299 -0.875 . . . . 0.0 110.628 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 9.1 mm-40 -96.18 -20.58 18.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.159 -0.963 . . . . 0.0 110.418 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' VAL . . . . . 0.648 HG22 ' O ' ' A' ' 62' ' ' PHE . 32.2 m -103.24 118.96 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.247 -0.908 . . . . 0.0 110.413 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -78.31 114.09 16.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ILE . . . . . 0.439 HD11 HD11 ' A' ' 7' ' ' LEU . 3.5 tp -88.52 137.42 30.52 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.296 -0.878 . . . . 0.0 110.053 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' A' ' 72' ' ' ILE . 46.7 Cg_endo -98.82 159.95 0.68 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.894 1.47 . . . . 0.0 110.329 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.82 -13.04 8.8 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.238 -0.914 . . . . 0.0 110.157 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 94.5 m -84.28 -38.01 20.99 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.265 -0.897 . . . . 0.0 110.028 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' ILE . . . . . 0.721 HG23 ' O ' ' A' ' 8' ' ' LYS . 72.4 mt -93.97 149.48 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.314 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 23.4 m -144.9 153.82 41.97 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.235 -0.915 . . . . 0.0 110.029 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.737 ' HB ' HD12 ' A' ' 7' ' ' LEU . 3.3 p -146.54 159.47 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.664 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.54 -179.36 5.86 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.386 -0.821 . . . . 0.0 110.164 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 m -107.93 170.88 7.72 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.177 -0.952 . . . . 0.0 110.719 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.37 -178.57 40.72 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.1 138.0 22.53 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.237 -1.155 . . . . 0.0 110.246 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 79' ' ' MET . . . . . 0.537 ' CE ' ' HB2' ' B' ' 6' ' ' HIS . 0.9 OUTLIER -121.06 170.71 9.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.243 -0.911 . . . . 0.0 110.092 179.847 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 80' ' ' SER . . . . . 0.422 ' O ' ' OG ' ' A' ' 80' ' ' SER . 1.3 p -137.73 103.92 5.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 110.408 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.541 ' O ' ' CG1' ' A' ' 81' ' ' ILE . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.114 -0.946 . . . . 0.0 109.976 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 64.8 mtp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.27 0.557 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.67 160.96 24.27 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 110.063 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 3' ' ' PRO . . . . . 0.515 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 49.9 Cg_endo -115.53 158.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 123.894 1.471 . . . . 0.0 110.04 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 4' ' ' ILE . . . . . 0.404 ' C ' HG23 ' B' ' 5' ' ' VAL . 5.0 pt -144.49 164.01 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 110.367 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 5' ' ' VAL . . . . . 0.469 HG21 ' CE1' ' B' ' 53' ' ' TYR . 98.0 t -145.84 127.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 109.955 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 6' ' ' HIS . . . . . 0.537 ' HB2' ' CE ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -105.47 116.1 31.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.232 -0.917 . . . . 0.0 110.537 -179.642 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 7' ' ' LEU . . . . . 0.893 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.6 OUTLIER -118.56 149.69 40.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.779 179.652 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 8' ' ' LYS . . . . . 0.743 ' O ' HG23 ' B' ' 72' ' ' ILE . 7.3 ttpt -142.43 172.31 12.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.076 -1.015 . . . . 0.0 110.461 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 9' ' ' GLY . . . . . 0.474 ' HA3' HG12 ' B' ' 72' ' ' ILE . . . 150.82 174.1 21.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 36.5 m-20 -65.08 138.55 58.39 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.152 -1.205 . . . . 0.0 110.252 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.47 -25.16 3.68 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 12' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' B' ' 15' ' ' LYS . 26.4 t30 -66.54 -61.49 1.96 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 0.0 110.692 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 13' ' ' THR . . . . . 0.522 ' HB ' HD11 ' B' ' 72' ' ' ILE . 0.2 OUTLIER -57.77 -31.72 66.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.053 -1.029 . . . . 0.0 110.388 -179.841 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.24 -30.55 69.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.184 -0.947 . . . . 0.0 110.008 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 15' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' B' ' 12' ' ' ASN . 10.2 mmtp -59.65 -45.45 91.97 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.19 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 16' ' ' CYS . . . . . 0.536 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 5.8 t -70.09 -36.25 74.77 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.881 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 17' ' ' LEU . . . . . 0.411 ' HA ' HD12 ' B' ' 17' ' ' LEU . 1.6 mp -58.94 -56.91 16.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.978 -1.076 . . . . 0.0 110.648 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 12.9 ttp85 -47.1 -21.43 0.24 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.263 -0.898 . . . . 0.0 110.655 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 19' ' ' TYR . . . . . 0.536 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 91.5 t80 -64.19 -27.23 68.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.072 -1.017 . . . . 0.0 109.759 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -79.77 -31.66 40.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.354 -0.841 . . . . 0.0 109.836 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 21' ' ' PHE . . . . . 0.554 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.4 m-30 -66.44 -15.01 63.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.289 -0.882 . . . . 0.0 110.068 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -63.36 -55.94 20.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 23' ' ' LYS . . . . . 0.497 ' N ' ' HD3' ' B' ' 23' ' ' LYS . 1.7 mptt -75.05 -22.59 58.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.216 -0.928 . . . . 0.0 110.252 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 24' ' ' HIS . . . . . 0.676 ' HB3' HD22 ' B' ' 27' ' ' LEU . 1.8 m-70 -95.01 38.63 1.12 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 25' ' ' CYS . . . . . 0.555 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 25.1 p -57.13 -25.45 58.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.183 -0.948 . . . . 0.0 110.521 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 14.9 t -97.57 11.37 37.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.191 -0.943 . . . . 0.0 110.615 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 27' ' ' LEU . . . . . 0.676 HD22 ' HB3' ' B' ' 24' ' ' HIS . 3.3 mp -92.3 -32.23 15.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.136 -0.978 . . . . 0.0 110.32 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 28' ' ' TYR . . . . . 0.555 ' CE1' ' HA ' ' B' ' 25' ' ' CYS . 50.2 p90 -113.49 172.06 7.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.236 -0.915 . . . . 0.0 109.665 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 29' ' ' THR . . . . . 0.475 ' HB ' ' O ' ' B' ' 52' ' ' THR . 57.3 m -101.49 -36.37 8.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.035 -1.04 . . . . 0.0 111.065 -179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.39 122.46 3.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.043 -1.035 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 31' ' ' VAL . . . . . 0.678 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.1 p -88.15 109.57 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.276 -0.89 . . . . 0.0 109.816 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 32' ' ' SER . . . . . 0.565 ' HB2' ' CZ3' ' A' ' 37' ' ' TRP . 0.3 OUTLIER -64.88 146.87 54.32 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.427 -0.796 . . . . 0.0 111.173 -179.254 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 78.4 p -61.41 163.06 7.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.373 -0.83 . . . . 0.0 110.081 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.25 115.77 8.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.338 -0.851 . . . . 0.0 110.512 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 35' ' ' TRP . . . . . 0.58 ' HB3' ' CB ' ' A' ' 35' ' ' TRP . 17.7 p-90 -146.99 168.97 20.2 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.126 -0.984 . . . . 0.0 110.13 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 36' ' ' HIS . . . . . 0.518 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 12.7 p-80 -162.6 178.54 8.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 110.734 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 37' ' ' TRP . . . . . 0.664 ' CH2' HG23 ' A' ' 52' ' ' THR . 79.5 m95 -79.72 125.05 29.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.487 -0.758 . . . . 0.0 110.218 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 38' ' ' THR . . . . . 0.443 ' CG2' ' HB3' ' A' ' 33' ' ' SER . 6.8 t . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.313 -0.867 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 47' ' ' ALA . . . . . 0.487 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.309 0.576 . . . . 0.0 110.091 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 48' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 7' ' ' LEU . 44.2 mt -140.74 131.89 29.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.208 -0.932 . . . . 0.0 110.2 -179.134 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 53.7 t -111.11 116.64 53.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.21 -0.931 . . . . 0.0 110.53 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 50' ' ' THR . . . . . 0.414 ' O ' ' HB3' ' B' ' 32' ' ' SER . 98.2 m -93.72 154.03 18.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -0.894 . . . . 0.0 109.535 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 mp -136.17 131.44 34.65 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 110.54 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 52' ' ' THR . . . . . 0.633 HG23 ' CH2' ' A' ' 37' ' ' TRP . 9.1 p -97.62 135.3 39.64 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.273 -0.892 . . . . 0.0 110.028 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 91.1 m-85 -111.46 148.7 32.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.085 -1.009 . . . . 0.0 110.354 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -82.46 -8.65 59.61 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.14 -0.975 . . . . 0.0 110.045 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.16 138.34 7.73 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 110.147 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -55.25 -39.25 69.55 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.339 -0.851 . . . . 0.0 110.169 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.71 -52.06 61.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 110.14 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 58' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 52.1 tt0 -57.07 -41.04 78.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.411 -0.805 . . . . 0.0 110.751 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -59.02 -36.2 74.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.977 -1.077 . . . . 0.0 110.267 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.272 -0.893 . . . . 0.0 110.984 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 61' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 47.5 mt-30 -65.42 -38.55 90.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.599 -179.334 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 62' ' ' PHE . . . . . 0.632 ' O ' HG22 ' B' ' 66' ' ' VAL . 4.0 t80 -54.85 -48.18 73.23 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.64 -25.79 64.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.215 -0.928 . . . . 0.0 110.388 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.22 -20.42 41.11 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.325 -0.859 . . . . 0.0 110.505 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 65' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' B' ' 61' ' ' GLN . 8.9 mm-40 -96.4 -19.31 19.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.286 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 66' ' ' VAL . . . . . 0.632 HG22 ' O ' ' B' ' 62' ' ' PHE . 30.1 m -104.9 118.38 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.2 -0.937 . . . . 0.0 110.232 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -77.94 114.51 16.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.268 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 68' ' ' ILE . . . . . 0.438 HD11 HD11 ' B' ' 7' ' ' LEU . 3.3 tp -88.74 137.26 30.19 Favored Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.228 -0.92 . . . . 0.0 110.151 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 69' ' ' PRO . . . . . 0.459 ' HD2' ' HB ' ' B' ' 72' ' ' ILE . 47.8 Cg_endo -98.43 160.25 0.76 Allowed 'Trans proline' 0 C--N 1.303 -1.832 0 O-C-N 123.911 1.48 . . . . 0.0 110.212 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.03 -12.95 9.31 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.16 -0.962 . . . . 0.0 110.12 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 87.1 m -84.49 -38.24 20.34 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 110.118 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 72' ' ' ILE . . . . . 0.743 HG23 ' O ' ' B' ' 8' ' ' LYS . 78.9 mt -93.81 149.76 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.219 -0.925 . . . . 0.0 110.229 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.4 m -144.87 153.87 42.04 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.33 -0.857 . . . . 0.0 110.147 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 74' ' ' VAL . . . . . 0.718 ' HB ' HD12 ' B' ' 7' ' ' LEU . 3.3 p -146.4 159.66 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.179 -0.95 . . . . 0.0 110.642 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 -179.55 6.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.418 -0.801 . . . . 0.0 110.04 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.5 m -107.8 170.93 7.69 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.081 -1.012 . . . . 0.0 110.715 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.5 -178.91 41.02 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -147.79 138.18 23.02 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -1.137 . . . . 0.0 110.34 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 79' ' ' MET . . . . . 0.488 ' CE ' ' HB2' ' A' ' 6' ' ' HIS . 0.5 OUTLIER -121.4 170.46 9.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.379 -0.825 . . . . 0.0 110.053 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 80' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' B' ' 80' ' ' SER . 1.3 p -137.64 104.24 5.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.17 -0.956 . . . . 0.0 110.341 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 81' ' ' ILE . . . . . 0.55 ' CG1' ' O ' ' B' ' 81' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.126 -0.984 . . . . 0.0 109.965 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.251 0.548 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.44 122.39 61.24 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.5 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -68.96 146.52 65.44 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.063 1.56 . . . . 0.0 110.197 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.422 ' CG1' ' O ' ' A' ' 4' ' ' ILE . 1.7 pp -143.98 117.38 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.168 -0.957 . . . . 0.0 110.364 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -94.13 153.38 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 109.999 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.585 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.2 OUTLIER -134.96 117.59 15.96 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.0 109.85 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.65 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.0 OUTLIER -113.66 148.65 35.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.311 -0.868 . . . . 0.0 110.199 -179.803 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.529 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 16.6 tttm -142.72 168.1 20.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 110.225 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.529 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 151.11 -156.38 26.64 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.14 127.57 32.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.238 -1.154 . . . . 0.0 110.342 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.579 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . . . -50.19 -27.03 5.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.099 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -77.75 -45.67 23.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.279 -0.888 . . . . 0.0 110.29 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 28.2 m -57.89 -21.76 44.88 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.163 -0.961 . . . . 0.0 110.086 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.987 ' HA ' HD12 ' A' ' 17' ' ' LEU . 30.6 mt -76.62 -29.69 56.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.872 . . . . 0.0 110.343 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -60.18 -39.46 86.54 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.229 -0.919 . . . . 0.0 110.59 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -69.91 -40.31 75.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.249 -0.907 . . . . 0.0 110.7 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.987 HD12 ' HA ' ' A' ' 14' ' ' LEU . 14.5 mt -58.51 -49.55 76.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.143 -0.973 . . . . 0.0 110.334 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.604 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 46.6 ttt-85 -45.04 -37.86 4.45 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.184 -0.948 . . . . 0.0 110.796 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.434 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 87.5 t80 -64.56 -41.77 96.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.103 -0.998 . . . . 0.0 110.344 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -57.67 -36.5 72.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.0 109.871 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 5.8 m-30 -66.79 -18.12 65.22 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.093 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 28.2 mmtt -63.31 -48.24 78.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.954 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.5 mmtt -74.83 -23.88 58.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.826 ' HB3' HD12 ' A' ' 27' ' ' LEU . 3.7 m-70 -95.23 33.92 1.49 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.967 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.563 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 21.2 p -56.75 -24.63 51.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.257 -0.902 . . . . 0.0 110.07 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.684 ' O ' HG23 ' A' ' 26' ' ' THR . 14.1 t -96.9 54.09 1.26 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 109.771 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.826 HD12 ' HB3' ' A' ' 24' ' ' HIS . 12.4 mt -147.78 -32.02 0.28 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -0.851 . . . . 0.0 110.755 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.563 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 9.2 p90 -108.76 167.51 10.01 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.928 -1.108 . . . . 0.0 110.012 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 m -100.66 -36.56 9.09 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.091 -1.006 . . . . 0.0 110.88 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.1 118.85 2.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.08 -1.013 . . . . 0.0 110.728 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.406 ' O ' HG13 ' A' ' 31' ' ' VAL . 9.8 p -89.94 136.06 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.266 -0.896 . . . . 0.0 109.935 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.599 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 28.4 p -96.36 149.83 21.26 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.071 -1.018 . . . . 0.0 110.303 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.31 162.02 8.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.22 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -68.0 127.88 34.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.328 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.602 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 40.9 p-90 -146.14 179.95 7.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.198 -0.939 . . . . 0.0 109.798 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.579 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 26.7 t-80 -162.71 173.82 13.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.863 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.579 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 55.9 m95 -78.6 93.35 4.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.401 -0.812 . . . . 0.0 109.834 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.6 t -74.18 157.63 35.59 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.312 -0.868 . . . . 0.0 110.42 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -171.2 165.67 38.76 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -54.35 -45.18 72.67 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -1.21 . . . . 0.0 109.977 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -112.95 112.91 24.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.341 -0.849 . . . . 0.0 110.161 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.431 ' H ' HG23 ' A' ' 42' ' ' VAL . 0.3 OUTLIER -96.89 -167.23 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.228 -0.92 . . . . 0.0 109.789 -179.852 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.4 tttt -131.35 -67.38 0.7 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.144 -0.973 . . . . 0.0 110.325 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -154.86 -158.59 0.86 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.923 . . . . 0.0 110.11 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.579 ' HD3' ' HB3' ' A' ' 11' ' ' ALA . 11.1 mttt -82.87 111.82 19.11 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -0.918 . . . . 0.0 110.186 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.507 ' O ' HG13 ' A' ' 48' ' ' ILE . 60.4 p -141.42 31.52 1.7 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.286 -0.884 . . . . 0.0 110.112 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.465 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -37.2 152.65 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.515 -0.741 . . . . 0.0 110.559 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.65 HG23 ' O ' ' A' ' 7' ' ' LEU . 40.6 mt -142.49 146.86 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.892 . . . . 0.0 110.115 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.21 178.18 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.185 -0.947 . . . . 0.0 110.25 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.522 ' OG1' ' CE1' ' A' ' 6' ' ' HIS . 53.9 m -145.91 151.18 37.43 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.267 -0.896 . . . . 0.0 110.159 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.72 128.91 31.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -0.998 . . . . 0.0 110.091 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -97.91 134.51 40.94 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.301 -0.874 . . . . 0.0 110.642 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.5 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 54.8 m-85 -112.72 151.51 30.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.298 -0.876 . . . . 0.0 110.053 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -76.7 -8.52 57.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 110.622 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.8 p -169.55 160.94 9.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.05 -1.031 . . . . 0.0 110.561 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.2 -41.94 80.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.203 -0.936 . . . . 0.0 109.932 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.48 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 51.7 t-105 -53.51 -52.39 59.77 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 61.7 tt0 -58.74 -30.56 67.59 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.188 -0.945 . . . . 0.0 109.685 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.1 -48.97 79.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.392 -0.817 . . . . 0.0 110.557 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.537 ' OD1' ' N ' ' A' ' 61' ' ' GLN . 2.5 p30 -61.17 -26.54 67.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.087 -1.008 . . . . 0.0 110.315 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.537 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 67.1 mt-30 -65.95 -52.03 53.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.151 -0.968 . . . . 0.0 109.97 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.652 ' O ' HG22 ' A' ' 66' ' ' VAL . 5.7 t80 -55.53 -46.32 77.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 109.718 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.3 mt -59.75 -21.87 61.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.33 -0.856 . . . . 0.0 110.198 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.91 -17.56 29.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 110.076 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -94.65 -14.74 24.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.312 -0.867 . . . . 0.0 110.351 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 62' ' ' PHE . 20.1 m -130.37 134.81 61.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -0.908 . . . . 0.0 110.137 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.5 tptp -86.52 120.05 27.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.205 -0.934 . . . . 0.0 110.322 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.635 HD11 HG23 ' A' ' 66' ' ' VAL . 4.8 mm -88.96 103.6 5.94 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.967 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.73 ' CG ' HD12 ' A' ' 72' ' ' ILE . 46.0 Cg_endo -39.9 154.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.094 1.576 . . . . 0.0 110.418 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 70' ' ' LYS . 13.6 mtpp -70.35 -14.86 62.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 0.0 110.459 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -84.66 -19.32 33.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.361 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.73 HD12 ' CG ' ' A' ' 69' ' ' PRO . 23.8 mt -93.81 123.59 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.6 m -94.7 136.6 34.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.458 -0.776 . . . . 0.0 110.416 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.588 HG12 ' N ' ' A' ' 75' ' ' SER . 92.9 t -90.73 171.99 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.565 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.588 ' N ' HG12 ' A' ' 74' ' ' VAL . 0.4 OUTLIER -142.45 152.82 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.387 -0.821 . . . . 0.0 110.661 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' B' ' 80' ' ' SER . 63.5 p -132.97 135.4 45.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.273 -0.892 . . . . 0.0 110.15 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.502 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -174.39 -173.63 40.53 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.502 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 50.2 m-85 -147.65 151.56 36.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.167 -1.196 . . . . 0.0 110.399 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.408 ' CE ' ' CE ' ' B' ' 79' ' ' MET . 25.5 mtt -119.78 174.84 6.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.182 -0.949 . . . . 0.0 110.287 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.464 ' C ' HG13 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -140.69 108.72 5.73 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.324 -0.86 . . . . 0.0 109.836 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.464 HG13 ' C ' ' A' ' 80' ' ' SER . 23.3 mt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.23 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mtm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.226 0.536 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.5 122.17 61.64 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.161 -0.962 . . . . 0.0 110.44 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.494 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.5 Cg_endo -68.79 146.86 67.62 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.978 1.515 . . . . 0.0 110.071 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.41 ' CG1' ' O ' ' B' ' 4' ' ' ILE . 1.7 pp -144.12 117.22 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.118 -0.989 . . . . 0.0 110.297 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 53.6 t -94.06 152.63 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.268 -0.895 . . . . 0.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.589 ' CB ' ' HB2' ' B' ' 75' ' ' SER . 0.2 OUTLIER -134.45 117.75 16.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.938 179.9 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.654 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.0 OUTLIER -113.86 148.81 36.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.284 -179.791 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.513 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 16.5 tttm -142.59 168.34 19.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.513 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 151.12 -156.76 26.84 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' ASP . . . . . 0.402 ' HB2' ' OG1' ' B' ' 13' ' ' THR . 53.5 m-20 -64.98 127.31 31.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -1.188 . . . . 0.0 110.293 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.563 ' HB3' ' HD3' ' B' ' 45' ' ' LYS . . . -50.09 -26.86 4.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.299 -0.876 . . . . 0.0 110.088 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -77.6 -45.92 23.74 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.19 -0.944 . . . . 0.0 110.219 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.402 ' OG1' ' HB2' ' B' ' 10' ' ' ASP . 28.1 m -57.96 -21.13 42.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.26 -0.9 . . . . 0.0 110.089 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 1.007 ' HA ' HD12 ' B' ' 17' ' ' LEU . 31.7 mt -77.24 -29.79 54.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.247 -0.908 . . . . 0.0 110.246 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -60.13 -38.84 84.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.879 . . . . 0.0 110.582 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.7 t -70.02 -40.19 75.35 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.192 -0.943 . . . . 0.0 110.8 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 1.007 HD12 ' HA ' ' B' ' 14' ' ' LEU . 14.0 mt -58.86 -50.13 75.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.128 -0.982 . . . . 0.0 110.349 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.594 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 46.5 ttt-85 -44.8 -37.26 3.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.924 . . . . 0.0 110.767 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 87.7 t80 -64.97 -41.56 95.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.991 -1.068 . . . . 0.0 110.239 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 mtt180 -58.21 -36.6 73.37 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.212 -0.93 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.594 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 5.8 m-30 -66.54 -17.8 65.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 22' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.1 mmtt -63.39 -48.54 77.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.203 -0.936 . . . . 0.0 110.035 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -74.66 -23.81 58.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.264 -0.898 . . . . 0.0 109.638 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.826 ' HB3' HD12 ' B' ' 27' ' ' LEU . 3.6 m-70 -95.23 34.05 1.47 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.347 -0.846 . . . . 0.0 109.832 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.536 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.2 p -56.74 -24.84 52.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.309 -0.87 . . . . 0.0 110.015 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.685 HG23 ' O ' ' B' ' 26' ' ' THR . 14.0 t -96.71 54.06 1.29 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.35 -0.844 . . . . 0.0 109.77 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.826 HD12 ' HB3' ' B' ' 24' ' ' HIS . 12.3 mt -147.76 -32.02 0.28 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.335 -0.853 . . . . 0.0 110.788 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.536 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 9.1 p90 -108.38 167.53 9.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.864 -1.148 . . . . 0.0 110.04 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 18.9 m -100.54 -36.88 9.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.193 -0.942 . . . . 0.0 110.698 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.87 118.93 2.8 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.054 -1.029 . . . . 0.0 110.733 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -89.95 136.81 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.296 -0.877 . . . . 0.0 109.827 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.602 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 26.8 p -97.37 150.46 20.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.135 -0.978 . . . . 0.0 110.451 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.36 161.74 8.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.368 -0.833 . . . . 0.0 110.43 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -68.15 127.55 33.31 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 110.365 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.599 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 39.8 p-90 -146.26 -179.97 7.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.66 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.575 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 27.5 t-80 -162.57 174.37 12.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.931 -1.105 . . . . 0.0 110.67 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.575 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 57.1 m95 -78.6 93.54 4.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.484 -0.76 . . . . 0.0 109.806 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 13.9 t -73.73 157.68 36.04 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.27 -0.894 . . . . 0.0 110.333 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -171.54 166.36 39.37 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.333 -1.507 . . . . 0.0 109.333 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -55.98 -43.91 78.06 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.229 -1.16 . . . . 0.0 110.132 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -114.24 111.6 21.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.235 -0.915 . . . . 0.0 110.061 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.25 -167.56 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.281 -0.887 . . . . 0.0 110.028 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -130.57 -68.44 0.69 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.213 -0.93 . . . . 0.0 110.233 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -153.78 -157.74 0.8 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.241 -0.912 . . . . 0.0 110.127 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 45' ' ' LYS . . . . . 0.563 ' HD3' ' HB3' ' B' ' 11' ' ' ALA . 11.1 mttt -83.6 111.22 18.91 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.221 -0.925 . . . . 0.0 110.176 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.508 ' O ' HG13 ' B' ' 48' ' ' ILE . 61.8 p -140.73 32.25 1.82 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.32 -0.862 . . . . 0.0 110.234 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.475 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -37.94 152.91 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.488 -0.757 . . . . 0.0 110.66 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.654 HG23 ' O ' ' B' ' 7' ' ' LEU . 38.7 mt -142.75 147.24 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 110.125 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.95 178.26 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.219 -0.926 . . . . 0.0 110.281 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.548 ' OG1' ' CE1' ' B' ' 6' ' ' HIS . 53.1 m -145.96 151.75 38.3 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.246 -0.909 . . . . 0.0 110.105 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.08 129.12 31.4 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.159 -0.963 . . . . 0.0 110.061 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 7.3 m -97.95 134.58 40.87 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.28 -0.888 . . . . 0.0 110.602 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.5 ' OH ' ' CG ' ' B' ' 62' ' ' PHE . 52.8 m-85 -112.84 151.6 30.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.315 -0.865 . . . . 0.0 110.065 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -76.31 -9.2 58.46 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.191 -0.943 . . . . 0.0 110.637 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 26.1 p -169.51 160.19 8.95 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.186 -0.946 . . . . 0.0 110.468 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.81 -42.15 86.37 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.196 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 57' ' ' TRP . . . . . 0.482 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 50.4 t-105 -53.53 -52.34 59.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.243 -0.911 . . . . 0.0 109.669 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 63.1 tt0 -58.85 -30.11 67.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.243 -0.911 . . . . 0.0 109.721 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.29 -49.18 78.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 110.464 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' B' ' 61' ' ' GLN . 2.3 p30 -61.18 -26.61 67.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.093 -1.005 . . . . 0.0 110.36 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.53 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 67.2 mt-30 -65.86 -52.09 53.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.19 -0.944 . . . . 0.0 109.851 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.661 ' O ' HG22 ' B' ' 66' ' ' VAL . 5.3 t80 -55.47 -46.3 76.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.824 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.2 mt -59.59 -22.07 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.0 110.136 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.71 -17.62 29.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.146 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -94.68 -13.96 25.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.293 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.661 HG22 ' O ' ' B' ' 62' ' ' PHE . 22.0 m -131.01 134.63 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.188 -0.945 . . . . 0.0 110.181 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -86.3 120.03 27.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.626 HD11 HG23 ' B' ' 66' ' ' VAL . 4.9 mm -89.02 103.76 6.3 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.979 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.783 ' CG ' HD12 ' B' ' 72' ' ' ILE . 45.8 Cg_endo -40.38 154.5 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.076 1.566 . . . . 0.0 110.495 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -70.5 -14.76 62.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.886 . . . . 0.0 110.486 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 28.4 m -84.58 -19.05 33.7 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.154 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.783 HD12 ' CG ' ' B' ' 69' ' ' PRO . 27.1 mt -94.32 123.71 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.33 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 24.3 m -94.8 136.64 34.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.38 -0.825 . . . . 0.0 110.495 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.595 HG12 ' N ' ' B' ' 75' ' ' SER . 99.4 t -90.79 172.07 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.264 -0.898 . . . . 0.0 110.602 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' SER . . . . . 0.595 ' N ' HG12 ' B' ' 74' ' ' VAL . 0.4 OUTLIER -142.29 153.56 44.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.358 -0.839 . . . . 0.0 110.658 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 76' ' ' THR . . . . . 0.436 ' O ' ' HB3' ' A' ' 80' ' ' SER . 52.5 p -133.56 135.74 44.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.529 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -174.61 -173.61 40.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.529 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 48.9 m-85 -147.81 149.92 33.24 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -1.117 . . . . 0.0 110.33 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.408 ' CE ' ' CE ' ' A' ' 79' ' ' MET . 26.0 mtt -118.69 173.22 6.98 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.226 -0.921 . . . . 0.0 110.351 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.477 ' C ' HG13 ' B' ' 81' ' ' ILE . 0.1 OUTLIER -139.43 107.95 5.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 110.086 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.477 HG13 ' C ' ' B' ' 80' ' ' SER . 29.7 mt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.169 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.4 mmm . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.327 0.584 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.572 ' O ' HG23 ' A' ' 2' ' ' THR . 14.8 t -88.42 125.96 61.84 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.903 . . . . 0.0 110.413 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.55 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -63.45 152.29 80.81 Favored 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 124.124 1.592 . . . . 0.0 110.209 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.418 ' C ' HG23 ' A' ' 5' ' ' VAL . 11.1 pt -144.16 164.04 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.211 -0.931 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.418 HG23 ' C ' ' A' ' 4' ' ' ILE . 41.3 t -146.14 136.88 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.159 -0.963 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.604 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.0 OUTLIER -105.2 131.38 52.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 109.599 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.508 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.4 OUTLIER -122.45 139.66 53.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.139 -0.976 . . . . 0.0 110.771 -179.407 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 80.6 tttt -142.3 170.85 14.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 110.164 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.499 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.44 -160.55 29.28 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.619 -1.393 . . . . 0.0 109.619 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.469 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 47.0 t0 -64.86 130.54 43.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -1.143 . . . . 0.0 110.336 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.1 -30.77 11.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.302 -0.873 . . . . 0.0 110.464 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -83.61 -48.39 10.26 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.263 -0.898 . . . . 0.0 110.527 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' A' ' 10' ' ' ASP . 91.7 m -57.88 -14.96 7.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 110.494 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.603 HD23 HD12 ' A' ' 17' ' ' LEU . 64.2 mt -82.48 -32.42 28.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 110.309 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -59.23 -36.62 75.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.239 -0.913 . . . . 0.0 110.031 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.7 t -70.11 -34.67 73.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.288 -0.883 . . . . 0.0 110.048 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.603 HD12 HD23 ' A' ' 14' ' ' LEU . 13.3 mt -58.77 -50.62 73.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.917 . . . . 0.0 109.939 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.575 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 34.5 ttt180 -46.23 -30.65 2.09 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.283 -0.885 . . . . 0.0 109.883 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 28.2 t80 -65.01 -46.55 80.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.399 -0.813 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -34.29 73.63 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.225 -0.922 . . . . 0.0 110.316 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.575 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.5 m-30 -66.38 -22.6 66.25 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 110.377 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 29.5 mmtt -63.62 -29.93 71.11 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.244 -0.91 . . . . 0.0 110.336 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -74.84 -47.75 28.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.5 ' HB3' HD22 ' A' ' 27' ' ' LEU . 16.0 m-70 -95.15 41.3 1.1 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.869 . . . . 0.0 109.965 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.578 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 24.5 p -56.8 -19.15 15.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 110.19 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 26' ' ' THR . 89.7 m -97.17 6.43 48.48 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.327 -0.858 . . . . 0.0 110.284 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -92.19 -7.67 47.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.291 -0.88 . . . . 0.0 110.187 -179.754 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.578 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 7.3 p90 -141.7 -176.76 4.88 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.027 -179.607 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.432 HG22 ' N ' ' A' ' 30' ' ' ALA . 1.3 m -94.84 -62.83 1.25 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.921 . . . . 0.0 109.191 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.432 ' N ' HG22 ' A' ' 29' ' ' THR . . . -157.18 143.86 18.25 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.929 -1.107 . . . . 0.0 108.72 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.616 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.7 p -90.02 110.76 22.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.9 0 O-C-N 121.639 -0.663 . . . . 0.0 110.325 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.587 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -53.24 146.15 12.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.213 -0.929 . . . . 0.0 110.009 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.55 ' HB2' ' CG2' ' B' ' 38' ' ' THR . 7.0 t -60.9 160.82 9.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 m -67.75 122.07 17.31 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.525 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.591 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 25.4 p-90 -147.1 166.7 26.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 109.83 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.497 ' ND1' ' HB2' ' A' ' 46' ' ' SER . 11.2 t-80 -162.58 -173.52 3.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.042 -1.036 . . . . 0.0 110.779 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.415 ' H ' ' CG ' ' A' ' 36' ' ' HIS . 19.4 m95 -79.53 101.67 8.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.501 -0.75 . . . . 0.0 110.379 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.54 ' CG2' ' HB2' ' B' ' 33' ' ' SER . 1.7 t -153.47 141.12 19.95 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.401 -0.812 . . . . 0.0 110.017 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.35 -34.21 84.48 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.903 -1.279 . . . . 0.0 109.903 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.419 ' O ' ' HB2' ' A' ' 41' ' ' ASN . 0.0 OUTLIER 179.7 -29.46 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.091 -1.24 . . . . 0.0 110.177 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.419 ' HB2' ' O ' ' A' ' 40' ' ' HIS . 8.5 t-20 -176.78 113.12 0.1 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.222 -0.923 . . . . 0.0 109.847 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -128.66 -179.14 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.231 -0.918 . . . . 0.0 110.58 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.467 ' O ' ' C ' ' A' ' 44' ' ' HIS . 25.5 mttt -86.79 -49.73 7.24 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.426 -0.796 . . . . 0.0 110.637 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.467 ' C ' ' O ' ' A' ' 43' ' ' LYS . 1.8 m80 -36.75 140.94 0.13 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.357 -0.839 . . . . 0.0 110.621 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.6 mttp -81.83 42.06 0.69 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.417 -0.802 . . . . 0.0 110.723 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.497 ' HB2' ' ND1' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -54.04 141.2 29.17 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.104 -0.997 . . . . 0.0 109.999 179.821 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -170.6 117.91 0.51 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.147 -0.971 . . . . 0.0 110.475 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.508 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.7 mt -140.55 155.6 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.275 -0.891 . . . . 0.0 110.297 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.9 t -138.75 118.47 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.385 -0.822 . . . . 0.0 110.394 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 86.9 m -94.3 158.13 15.72 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.251 -0.905 . . . . 0.0 110.314 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.97 134.24 38.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.274 -0.892 . . . . 0.0 110.112 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.38 123.94 40.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.228 -0.92 . . . . 0.0 110.341 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.55 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 58.5 m-85 -103.32 146.83 27.88 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.351 -0.843 . . . . 0.0 109.85 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.09 -8.25 58.81 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.203 -0.935 . . . . 0.0 110.658 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.9 p -171.15 134.11 0.9 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.961 . . . . 0.0 110.374 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.518 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 44.4 mt-10 -50.08 -37.54 34.16 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.249 -0.907 . . . . 0.0 109.988 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 35.5 t-105 -53.83 -58.87 5.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.076 -1.015 . . . . 0.0 109.799 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -58.47 -28.74 65.62 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.161 -0.962 . . . . 0.0 110.337 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.518 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 53.6 ttp180 -59.56 -48.38 81.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.154 -0.967 . . . . 0.0 110.984 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.601 ' HA ' HD21 ' A' ' 63' ' ' LEU . 1.1 p30 -60.93 -33.67 73.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.093 -1.004 . . . . 0.0 110.741 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.519 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 57.5 mt-30 -65.65 -47.57 75.12 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.148 -0.97 . . . . 0.0 110.271 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.545 ' HA ' HD23 ' A' ' 27' ' ' LEU . 36.2 t80 -55.8 -65.24 0.63 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.38 -0.825 . . . . 0.0 110.664 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 60' ' ' ASP . 3.0 pp -59.39 -18.33 37.88 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 3.6 t -81.84 -20.68 38.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 0.0 110.128 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.52 -73.03 0.6 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.273 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 62' ' ' PHE . 34.3 m -48.14 130.18 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.113 -0.992 . . . . 0.0 109.992 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.7 108.43 6.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.179 -0.95 . . . . 0.0 110.492 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 30.9 mt -89.21 121.37 69.54 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.377 -0.827 . . . . 0.0 110.09 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -56.26 179.01 0.1 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 123.899 1.473 . . . . 0.0 110.528 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -92.19 -12.43 32.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 110.133 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.3 m -84.62 -16.69 41.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.249 -0.907 . . . . 0.0 110.305 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.522 ' CD1' ' N ' ' A' ' 72' ' ' ILE . 1.2 mp -94.06 119.39 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.243 -0.911 . . . . 0.0 110.041 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.56 139.75 30.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.32 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.55 HG22 ' N ' ' A' ' 75' ' ' SER . 8.4 p -90.71 170.54 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.245 -0.909 . . . . 0.0 110.46 -179.335 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.616 ' OG ' HG22 ' B' ' 81' ' ' ILE . 0.2 OUTLIER -143.85 158.84 43.42 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.345 -0.847 . . . . 0.0 110.988 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.7 p -133.37 134.19 43.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.39 -0.819 . . . . 0.0 109.854 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -167.75 -168.22 29.56 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -147.78 149.15 31.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.232 -1.158 . . . . 0.0 110.334 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 24.5 mmm -124.75 154.48 40.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 110.092 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.516 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.7 OUTLIER -130.23 103.86 6.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -0.963 . . . . 0.0 110.394 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.565 HG22 ' OG ' ' B' ' 75' ' ' SER . 13.2 pt . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.194 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.6 mmm . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.173 0.511 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.576 ' O ' HG23 ' B' ' 2' ' ' THR . 14.7 t -88.65 125.42 63.14 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.269 -0.894 . . . . 0.0 110.48 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.548 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.1 Cg_endo -63.35 152.27 80.78 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.051 1.553 . . . . 0.0 110.408 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.436 ' C ' HG23 ' B' ' 5' ' ' VAL . 10.3 pt -144.12 164.39 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.232 -0.918 . . . . 0.0 110.397 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.436 HG23 ' C ' ' B' ' 4' ' ' ILE . 41.5 t -146.32 137.27 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.269 -0.895 . . . . 0.0 110.437 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.618 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.0 OUTLIER -105.4 131.0 53.37 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.349 -0.844 . . . . 0.0 109.582 179.585 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.501 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.4 OUTLIER -122.22 139.85 53.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.065 -1.022 . . . . 0.0 110.703 -179.408 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.491 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 80.5 tttt -142.35 170.43 15.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 110.176 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.491 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.81 -160.5 29.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 10' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 45.8 t0 -64.94 130.98 45.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -1.139 . . . . 0.0 110.372 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.33 -30.93 13.18 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.311 -0.868 . . . . 0.0 110.388 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -83.92 -48.25 10.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.264 -0.898 . . . . 0.0 110.508 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' B' ' 10' ' ' ASP . 99.2 m -57.78 -14.57 6.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.597 HD23 HD12 ' B' ' 17' ' ' LEU . 70.4 mt -83.04 -32.22 26.99 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.313 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -59.53 -35.91 75.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.156 -0.965 . . . . 0.0 110.065 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.447 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.7 t -70.46 -34.82 72.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.198 -0.939 . . . . 0.0 110.108 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.597 HD12 HD23 ' B' ' 14' ' ' LEU . 13.6 mt -58.84 -50.77 72.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 0.0 110.164 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.588 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 33.1 ttt180 -46.29 -30.19 1.95 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.293 -0.88 . . . . 0.0 109.903 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.473 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 30.0 t80 -65.06 -47.3 77.8 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.405 -0.809 . . . . 0.0 110.319 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.71 -33.9 72.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.209 -0.932 . . . . 0.0 110.27 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.588 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.4 m-30 -66.72 -22.87 66.05 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.0 110.293 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 22' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.7 mmtt -63.37 -30.02 71.22 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.95 . . . . 0.0 110.412 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -74.92 -48.04 26.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.195 -0.941 . . . . 0.0 110.052 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.515 ' HB3' ' HB2' ' B' ' 27' ' ' LEU . 15.8 m-70 -94.82 41.63 1.09 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.269 -0.894 . . . . 0.0 110.063 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.566 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 25.2 p -57.04 -18.87 15.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.336 -0.853 . . . . 0.0 110.14 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.512 HG22 ' O ' ' B' ' 26' ' ' THR . 86.8 m -97.27 6.11 48.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.858 . . . . 0.0 110.199 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' B' ' 62' ' ' PHE . 0.7 OUTLIER -92.26 -6.2 50.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.224 -0.922 . . . . 0.0 110.324 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.566 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 7.6 p90 -143.29 -177.1 5.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.372 -0.83 . . . . 0.0 109.836 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.442 HG22 ' N ' ' B' ' 30' ' ' ALA . 1.3 m -94.8 -63.23 1.2 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.244 -0.91 . . . . 0.0 109.214 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.442 ' N ' HG22 ' B' ' 29' ' ' THR . . . -156.8 143.09 18.17 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 120.985 -1.072 . . . . 0.0 108.625 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.594 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.5 p -89.95 110.77 22.29 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 110.268 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.591 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -52.7 145.84 11.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.4 -0.812 . . . . 0.0 110.195 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 33' ' ' SER . . . . . 0.54 ' HB2' ' CG2' ' A' ' 38' ' ' THR . 6.8 t -60.66 160.86 8.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.284 -0.885 . . . . 0.0 110.102 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -67.99 122.73 18.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -0.901 . . . . 0.0 110.38 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.587 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 26.1 p-90 -147.76 167.02 25.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.618 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.49 ' ND1' ' HB2' ' B' ' 46' ' ' SER . 12.3 t-80 -162.61 -173.66 3.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.019 -1.051 . . . . 0.0 110.815 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.41 ' H ' ' CG ' ' B' ' 36' ' ' HIS . 19.9 m95 -79.43 100.79 7.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.535 -0.728 . . . . 0.0 110.379 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.55 ' CG2' ' HB2' ' A' ' 33' ' ' SER . 1.4 t -151.7 142.28 22.68 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.388 -0.82 . . . . 0.0 110.241 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -68.06 -34.2 80.85 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' HIS . . . . . 0.453 ' CE1' ' HB2' ' B' ' 41' ' ' ASN . 0.0 OUTLIER 179.38 -31.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.295 -1.121 . . . . 0.0 109.734 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 41' ' ' ASN . . . . . 0.453 ' HB2' ' CE1' ' B' ' 40' ' ' HIS . 7.9 t-20 -174.98 115.18 0.16 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.332 -0.855 . . . . 0.0 109.863 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.3 -178.82 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.243 -0.91 . . . . 0.0 110.197 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.475 ' O ' ' C ' ' B' ' 44' ' ' HIS . 26.1 mttt -87.56 -49.69 7.01 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.287 -0.883 . . . . 0.0 110.611 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 44' ' ' HIS . . . . . 0.475 ' C ' ' O ' ' B' ' 43' ' ' LYS . 1.8 m80 -36.07 140.92 0.11 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.478 -0.764 . . . . 0.0 110.574 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -82.28 44.04 0.84 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.351 -0.843 . . . . 0.0 110.579 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.49 ' HB2' ' ND1' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -55.97 140.45 43.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.179 -0.951 . . . . 0.0 109.811 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -169.96 117.88 0.58 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.204 -0.935 . . . . 0.0 110.596 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.501 HG23 ' O ' ' B' ' 7' ' ' LEU . 2.5 mt -140.49 155.75 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 110.338 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 62.1 t -138.57 117.89 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.467 ' HG1' ' CE1' ' B' ' 6' ' ' HIS . 93.9 m -93.77 158.49 15.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.208 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.33 134.42 37.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.973 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.5 124.63 40.55 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.223 -0.923 . . . . 0.0 110.47 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.548 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -104.09 146.79 28.22 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.335 -0.853 . . . . 0.0 109.887 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -79.17 -8.23 58.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.16 -0.963 . . . . 0.0 110.487 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 84.3 p -170.71 135.01 1.09 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.203 -0.935 . . . . 0.0 110.252 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.522 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 42.9 mt-10 -51.17 -37.43 46.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.965 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 57' ' ' TRP . . . . . 0.481 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 35.3 t-105 -53.82 -58.57 6.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.124 -0.985 . . . . 0.0 109.81 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -58.78 -28.54 66.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.173 -0.954 . . . . 0.0 110.327 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.522 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 54.0 ttp180 -59.47 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.143 -0.973 . . . . 0.0 110.853 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.605 ' HA ' HD21 ' B' ' 63' ' ' LEU . 1.1 p30 -61.04 -33.76 73.79 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.056 -1.027 . . . . 0.0 110.785 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.516 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 56.7 mt-30 -65.78 -47.26 75.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.062 -1.024 . . . . 0.0 110.122 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.55 ' HA ' HD23 ' B' ' 27' ' ' LEU . 37.2 t80 -55.88 -65.49 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 110.646 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' B' ' 60' ' ' ASP . 2.9 pp -59.13 -18.85 39.47 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.352 -0.842 . . . . 0.0 110.426 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 3.3 t -81.54 -20.32 40.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.127 -0.983 . . . . 0.0 110.171 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.68 -73.5 0.59 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.105 -0.997 . . . . 0.0 110.244 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.51 HG22 ' O ' ' B' ' 62' ' ' PHE . 34.0 m -47.54 130.17 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.212 -0.93 . . . . 0.0 109.937 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.53 108.7 6.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.173 -0.954 . . . . 0.0 110.426 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 25.1 mt -89.47 121.89 68.86 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.011 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.418 ' HG2' HD13 ' B' ' 72' ' ' ILE . 47.1 Cg_endo -57.0 178.55 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 123.968 1.509 . . . . 0.0 110.557 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -91.75 -12.34 34.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.206 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.1 m -84.76 -16.79 40.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.212 -0.93 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.52 ' CD1' ' N ' ' B' ' 72' ' ' ILE . 1.2 mp -93.96 119.14 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.147 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.43 139.69 30.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.328 -0.857 . . . . 0.0 110.175 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.56 HG22 ' N ' ' B' ' 75' ' ' SER . 8.4 p -90.6 170.69 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 110.518 -179.383 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 75' ' ' SER . . . . . 0.618 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.87 158.53 43.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.432 -0.792 . . . . 0.0 111.008 179.823 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 82.8 p -133.34 134.21 43.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.453 -0.779 . . . . 0.0 109.97 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -168.21 -167.84 29.45 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -147.81 149.45 32.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.1 -1.235 . . . . 0.0 110.507 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.425 ' HE3' HG23 ' B' ' 81' ' ' ILE . 24.1 mmm -125.09 153.18 43.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.169 -0.957 . . . . 0.0 110.017 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.518 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.7 OUTLIER -128.89 104.41 7.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.211 -0.931 . . . . 0.0 110.24 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.616 HG22 ' OG ' ' A' ' 75' ' ' SER . 13.7 pt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.181 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 mtm . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.171 0.51 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -94.72 118.09 66.85 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.175 -0.953 . . . . 0.0 110.15 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 50.6 Cg_endo -53.54 147.0 40.37 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.093 1.575 . . . . 0.0 110.411 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.446 HG23 ' O ' ' A' ' 2' ' ' THR . 1.1 pt -143.06 109.93 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.34 -0.85 . . . . 0.0 110.024 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.95 153.92 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 110.424 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.6 ' CE1' ' OG1' ' A' ' 50' ' ' THR . 0.1 OUTLIER -134.71 117.14 15.7 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.372 -0.83 . . . . 0.0 109.821 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.55 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.8 OUTLIER -112.74 145.36 40.68 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 -179.716 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 72' ' ' ILE . 20.4 tttm -143.42 169.8 16.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.265 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.79 -157.35 27.24 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.481 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 81.9 m-20 -64.79 123.5 19.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.179 -1.189 . . . . 0.0 109.948 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.806 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.77 -43.94 48.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.842 . . . . 0.0 110.632 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.42 -48.22 82.68 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.241 -0.912 . . . . 0.0 110.451 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.4 m -57.96 -28.19 64.12 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.301 -0.874 . . . . 0.0 110.419 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.806 HD12 ' HA ' ' A' ' 11' ' ' ALA . 97.5 mt -65.69 -30.03 70.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.214 -0.929 . . . . 0.0 110.042 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.1 -36.92 78.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.32 -0.862 . . . . 0.0 110.147 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.548 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 4.6 t -70.06 -40.56 75.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 110.762 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.405 HD11 ' CD1' ' A' ' 72' ' ' ILE . 1.0 OUTLIER -58.75 -52.03 67.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.973 -1.079 . . . . 0.0 110.188 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.527 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 7.3 ttt-85 -48.31 -27.6 2.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.886 . . . . 0.0 110.258 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.548 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 64.6 t80 -64.65 -25.74 68.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.224 -0.922 . . . . 0.0 110.074 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -83.55 -25.33 31.07 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.228 -0.92 . . . . 0.0 109.919 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.565 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.2 m-30 -66.5 -22.62 66.18 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.387 -0.821 . . . . 0.0 110.439 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -63.32 -47.35 82.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.06 -20.26 59.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.189 -0.944 . . . . 0.0 109.839 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.895 ' HB3' HD12 ' A' ' 27' ' ' LEU . 20.8 m170 -95.42 39.67 1.12 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 110.161 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.493 ' SG ' ' N ' ' A' ' 26' ' ' THR . 19.3 p -57.06 -36.2 70.24 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.11 -0.994 . . . . 0.0 110.368 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.551 ' O ' HG23 ' A' ' 26' ' ' THR . 8.7 t -97.27 67.04 2.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.134 -0.979 . . . . 0.0 110.543 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.895 HD12 ' HB3' ' A' ' 24' ' ' HIS . 10.0 mt -148.11 -43.95 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.258 -0.901 . . . . 0.0 110.074 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -107.11 170.25 8.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.208 -0.932 . . . . 0.0 109.725 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.445 HG23 ' OD2' ' A' ' 54' ' ' ASP . 0.2 OUTLIER -100.34 -33.84 10.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.087 -1.008 . . . . 0.0 111.046 -179.348 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.417 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -159.73 116.82 2.6 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.097 . . . . 0.0 110.924 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.46 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.4 p -90.03 131.33 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 110.019 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.582 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 53.8 p -86.02 149.23 25.31 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.251 -0.905 . . . . 0.0 110.302 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.0 t -61.36 161.58 9.01 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.142 -0.974 . . . . 0.0 110.013 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.87 128.37 36.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.326 -0.859 . . . . 0.0 110.406 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 36.6 p-90 -146.36 -179.25 6.62 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.294 -0.879 . . . . 0.0 109.77 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.553 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 32.8 t60 -162.56 169.71 19.79 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.1 -1.0 . . . . 0.0 110.208 -179.535 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.553 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 56.4 m95 -79.07 110.01 13.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.212 -0.93 . . . . 0.0 110.159 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -75.95 -155.82 0.06 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.274 -0.891 . . . . 0.0 110.183 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.71 147.2 4.67 Favored Glycine 0 N--CA 1.488 2.124 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -49.43 -30.86 8.67 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.232 -1.157 . . . . 0.0 110.144 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -114.03 136.21 53.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.221 -0.925 . . . . 0.0 110.08 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -168.46 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.177 -0.952 . . . . 0.0 109.883 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -149.73 -70.47 0.19 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.149 -0.969 . . . . 0.0 110.453 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -147.23 -170.76 3.63 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.241 -0.912 . . . . 0.0 110.308 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 11.8 mttt -74.83 107.92 7.23 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.374 -0.829 . . . . 0.0 109.889 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.531 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.7 OUTLIER -125.6 26.78 6.65 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -0.927 . . . . 0.0 110.356 -179.775 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.502 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . -35.99 145.69 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.493 -0.754 . . . . 0.0 110.516 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.55 HG23 ' O ' ' A' ' 7' ' ' LEU . 10.0 mt -142.48 157.71 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.226 -0.921 . . . . 0.0 109.915 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.522 HG13 ' N ' ' A' ' 50' ' ' THR . 0.4 OUTLIER -139.0 179.51 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.154 -0.966 . . . . 0.0 110.521 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.6 ' OG1' ' CE1' ' A' ' 6' ' ' HIS . 49.2 m -145.65 153.77 41.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.391 -0.818 . . . . 0.0 109.571 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.91 128.79 35.28 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.034 -1.042 . . . . 0.0 110.342 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -96.98 127.13 42.64 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.368 -0.833 . . . . 0.0 110.168 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.536 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 53.8 m-85 -106.85 147.79 29.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.31 -0.869 . . . . 0.0 110.064 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.445 ' OD2' HG23 ' A' ' 29' ' ' THR . 0.3 OUTLIER -71.44 -6.02 37.2 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.847 . . . . 0.0 110.773 -179.602 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 p -175.84 174.51 2.15 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -1.0 . . . . 0.0 110.594 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.98 -44.98 45.18 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.317 -0.865 . . . . 0.0 110.353 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.505 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 67.0 t-105 -53.62 -50.09 66.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.175 -0.953 . . . . 0.0 109.916 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 53.9 tt0 -57.08 -39.56 75.21 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 110.586 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.488 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 6.4 ttp180 -59.26 -40.67 86.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.98 -1.075 . . . . 0.0 110.643 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.505 ' OD2' ' O ' ' A' ' 57' ' ' TRP . 0.0 OUTLIER -61.45 -39.61 91.48 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.096 -1.003 . . . . 0.0 110.749 -179.429 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 23.1 mt-30 -65.4 -44.12 88.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.226 -0.921 . . . . 0.0 110.481 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.754 ' O ' HG22 ' A' ' 66' ' ' VAL . 86.2 t80 -55.3 -42.01 73.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.179 -0.951 . . . . 0.0 110.119 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.5 mt -59.61 -13.24 8.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.7 p -98.83 -14.87 19.47 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.194 -0.941 . . . . 0.0 110.423 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 4.5 mm-40 -96.48 -12.65 23.87 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.173 -0.954 . . . . 0.0 109.992 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.754 HG22 ' O ' ' A' ' 62' ' ' PHE . 13.8 m -133.22 105.21 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.302 -0.874 . . . . 0.0 110.084 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -62.37 123.66 18.84 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 110.398 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.43 ' HA ' HD13 ' A' ' 68' ' ' ILE . 25.3 mm -88.95 113.45 56.1 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.293 -0.88 . . . . 0.0 110.266 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.462 ' HG2' ' CG1' ' A' ' 72' ' ' ILE . 44.3 Cg_endo -56.61 152.33 41.72 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.042 1.548 . . . . 0.0 110.499 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -68.75 -11.85 60.79 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.275 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.2 m -84.64 -24.89 28.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.198 -0.939 . . . . 0.0 109.974 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.471 HG23 ' O ' ' A' ' 8' ' ' LYS . 12.3 mt -94.12 123.45 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.466 -0.771 . . . . 0.0 110.148 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -94.48 138.0 32.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.23 -0.919 . . . . 0.0 110.023 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -91.26 172.59 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.204 -0.935 . . . . 0.0 110.574 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.549 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.89 155.41 44.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.566 -0.708 . . . . 0.0 110.381 179.524 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.482 ' O ' ' HB3' ' B' ' 80' ' ' SER . 0.6 OUTLIER -133.19 136.13 45.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 110.186 179.26 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.41 ' O ' HG13 ' A' ' 4' ' ' ILE . . . -176.39 -172.33 40.98 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.446 ' HA ' HG12 ' A' ' 4' ' ' ILE . 97.7 m-85 -148.14 155.18 41.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.09 -1.241 . . . . 0.0 110.64 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' B' ' 79' ' ' MET . 27.2 mtt -123.64 174.79 7.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.333 -0.855 . . . . 0.0 110.168 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.488 ' C ' ' CG1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -139.08 109.19 6.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 110.085 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.488 ' CG1' ' C ' ' A' ' 80' ' ' SER . 10.8 mt . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.173 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.1 mtm . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.276 0.56 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.43 ' O ' HG23 ' B' ' 4' ' ' ILE . 0.0 OUTLIER -94.07 118.07 67.19 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.319 -0.863 . . . . 0.0 110.078 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 49.8 Cg_endo -53.9 147.61 41.42 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.942 1.496 . . . . 0.0 110.496 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.434 HG12 ' CA ' ' B' ' 78' ' ' PHE . 1.1 pt -142.95 109.52 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.984 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -93.8 153.13 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.306 -0.871 . . . . 0.0 110.271 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.552 ' CE1' ' OG1' ' B' ' 50' ' ' THR . 0.1 OUTLIER -134.13 117.17 16.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.332 -0.855 . . . . 0.0 109.952 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.565 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.8 OUTLIER -112.87 145.5 40.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.178 -0.951 . . . . 0.0 110.33 -179.785 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.468 ' O ' HG23 ' B' ' 72' ' ' ILE . 19.9 tttm -143.46 169.76 17.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.294 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.71 -157.38 27.26 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 81.8 m-20 -64.57 123.1 18.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.18 -1.188 . . . . 0.0 110.041 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.807 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.9 -43.24 49.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.297 -0.877 . . . . 0.0 110.571 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -60.48 -48.33 82.22 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.194 -0.941 . . . . 0.0 110.358 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.9 m -58.31 -28.42 65.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.452 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' B' ' 11' ' ' ALA . 94.3 mt -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.905 . . . . 0.0 110.145 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -60.12 -36.96 78.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.3 -0.875 . . . . 0.0 110.19 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 4.7 t -70.0 -40.55 75.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 110.64 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.41 HD11 ' CD1' ' B' ' 72' ' ' ILE . 1.0 OUTLIER -58.83 -51.81 68.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.014 -1.054 . . . . 0.0 110.252 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.521 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 7.3 ttt-85 -48.29 -27.4 2.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.37 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.547 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 65.4 t80 -64.6 -26.33 68.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.277 -0.889 . . . . 0.0 110.15 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -82.89 -25.27 32.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.915 . . . . 0.0 109.943 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.575 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.3 m-30 -66.46 -23.04 66.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.359 -0.838 . . . . 0.0 110.425 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -63.21 -47.01 84.35 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.25 -0.906 . . . . 0.0 110.304 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.11 -20.71 59.31 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.179 -0.951 . . . . 0.0 109.859 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.899 ' HB3' HD12 ' B' ' 27' ' ' LEU . 20.7 m170 -95.11 40.01 1.11 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.462 -0.773 . . . . 0.0 110.072 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' B' ' 26' ' ' THR . 18.5 p -57.3 -36.49 71.13 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.91 . . . . 0.0 110.354 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.527 HG23 ' O ' ' B' ' 26' ' ' THR . 7.0 t -97.21 67.05 2.13 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.149 -0.969 . . . . 0.0 110.582 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.899 HD12 ' HB3' ' B' ' 24' ' ' HIS . 10.1 mt -148.16 -44.38 0.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.204 -0.935 . . . . 0.0 110.049 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -106.49 170.31 8.0 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.204 -0.935 . . . . 0.0 109.763 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.444 HG23 ' OD2' ' B' ' 54' ' ' ASP . 0.2 OUTLIER -100.26 -33.95 10.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.021 -1.05 . . . . 0.0 111.005 -179.314 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.401 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -159.67 116.91 2.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.991 -1.068 . . . . 0.0 110.866 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.479 ' O ' HG13 ' B' ' 31' ' ' VAL . 6.9 p -90.11 130.1 39.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.262 -0.899 . . . . 0.0 109.935 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.58 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 57.6 p -84.58 149.37 25.92 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.223 -0.923 . . . . 0.0 110.295 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -61.45 162.22 8.34 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.088 -1.008 . . . . 0.0 110.219 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.98 127.85 34.36 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.896 . . . . 0.0 110.269 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.582 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 37.9 p-90 -146.14 -178.92 6.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.22 -0.925 . . . . 0.0 109.882 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.551 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 34.0 t60 -162.56 169.38 20.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.054 -1.029 . . . . 0.0 110.414 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.551 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 58.1 m95 -79.07 110.15 14.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 109.903 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t -76.03 -155.69 0.06 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.225 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.84 145.79 4.43 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -48.19 -31.79 6.21 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.125 -1.221 . . . . 0.0 110.024 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -113.44 135.56 53.75 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.307 -0.87 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -117.65 -168.88 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.188 -0.945 . . . . 0.0 109.927 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -149.39 -70.37 0.2 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.451 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -147.29 -172.05 3.93 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.157 -0.964 . . . . 0.0 110.352 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -73.71 106.98 5.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.312 -0.868 . . . . 0.0 110.0 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.527 ' O ' HG13 ' B' ' 48' ' ' ILE . 0.7 OUTLIER -124.97 27.55 6.69 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.195 -0.941 . . . . 0.0 110.492 -179.781 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.503 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . . . -36.74 145.87 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.447 -0.783 . . . . 0.0 110.621 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.565 HG23 ' O ' ' B' ' 7' ' ' LEU . 9.2 mt -142.65 157.95 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.345 -0.847 . . . . 0.0 109.963 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 49' ' ' VAL . . . . . 0.532 HG13 ' N ' ' B' ' 50' ' ' THR . 0.4 OUTLIER -139.14 179.95 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.123 -0.985 . . . . 0.0 110.637 -179.751 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.552 ' OG1' ' CE1' ' B' ' 6' ' ' HIS . 54.5 m -145.9 153.07 40.44 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 109.811 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.3 128.84 36.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.166 -0.959 . . . . 0.0 110.464 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 4.7 m -97.12 126.92 42.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.371 -0.83 . . . . 0.0 110.246 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.522 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 56.6 m-85 -106.87 148.17 28.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.258 -0.901 . . . . 0.0 110.013 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.444 ' OD2' HG23 ' B' ' 29' ' ' THR . 0.3 OUTLIER -72.15 -6.41 42.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.805 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 p -174.81 174.89 2.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.064 -1.023 . . . . 0.0 110.264 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -75.91 -44.14 41.75 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 67.0 t-105 -53.64 -49.95 66.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.881 . . . . 0.0 110.197 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.0 tt0 -57.3 -39.39 75.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.22 -0.925 . . . . 0.0 110.645 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.467 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 6.3 ttp180 -59.29 -41.35 88.75 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.138 -0.976 . . . . 0.0 110.714 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.485 ' OD2' ' O ' ' B' ' 57' ' ' TRP . 0.0 OUTLIER -61.19 -39.18 89.22 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.124 -0.985 . . . . 0.0 110.741 -179.386 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 23.3 mt-30 -65.42 -44.24 87.97 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.089 -1.007 . . . . 0.0 110.437 -179.495 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.745 ' O ' HG22 ' B' ' 66' ' ' VAL . 83.7 t80 -55.28 -41.8 72.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.137 -0.977 . . . . 0.0 109.935 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.0 mt -59.68 -12.56 7.18 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.246 -0.909 . . . . 0.0 110.176 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 12.3 p -99.5 -14.79 18.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.228 -0.92 . . . . 0.0 110.488 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' B' ' 61' ' ' GLN . 4.5 mm-40 -96.45 -12.68 23.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 110.113 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.745 HG22 ' O ' ' B' ' 62' ' ' PHE . 13.1 m -133.26 104.65 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.351 -0.843 . . . . 0.0 110.171 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.6 tptp -62.0 123.86 19.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.428 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.421 ' HA ' HD13 ' B' ' 68' ' ' ILE . 25.3 mm -88.95 113.42 55.98 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.288 -0.883 . . . . 0.0 110.298 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.473 ' HG2' ' CG1' ' B' ' 72' ' ' ILE . 45.0 Cg_endo -56.4 152.6 38.73 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.957 1.504 . . . . 0.0 110.423 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -69.29 -11.86 61.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.219 -0.926 . . . . 0.0 110.29 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 10.7 m -84.48 -24.63 29.35 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.252 -0.905 . . . . 0.0 109.882 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.473 ' CG1' ' HG2' ' B' ' 69' ' ' PRO . 12.2 mt -94.37 123.41 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.275 -0.89 . . . . 0.0 110.267 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 99.1 m -94.53 138.07 32.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.163 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.424 ' H ' HG23 ' B' ' 74' ' ' VAL . 1.7 t -91.32 172.49 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' SER . . . . . 0.536 ' HB3' ' HB2' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -143.09 155.65 44.65 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.517 -0.74 . . . . 0.0 110.346 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 76' ' ' THR . . . . . 0.458 ' O ' ' HB3' ' A' ' 80' ' ' SER . 0.6 OUTLIER -133.41 135.63 44.74 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.18 -0.95 . . . . 0.0 110.203 179.361 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.405 ' O ' HG13 ' B' ' 4' ' ' ILE . . . -175.35 -172.21 40.03 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.434 ' CA ' HG12 ' B' ' 4' ' ' ILE . 97.7 m-85 -147.98 155.12 41.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.109 -1.23 . . . . 0.0 110.524 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' A' ' 79' ' ' MET . 27.4 mtt -123.98 173.75 8.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.405 -0.809 . . . . 0.0 110.052 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.487 ' C ' ' CG1' ' B' ' 81' ' ' ILE . 0.0 OUTLIER -138.23 109.14 6.71 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.19 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.487 ' CG1' ' C ' ' B' ' 80' ' ' SER . 10.4 mt . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.108 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' A' ' 2' ' ' THR . 70.1 mtm . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.213 0.53 . . . . 0.0 110.176 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' A' ' 1' ' ' MET . 76.7 m -43.71 105.23 0.42 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 46.5 Cg_endo -56.42 157.65 17.77 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 O-C-N 124.15 1.605 . . . . 0.0 110.743 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.541 HG22 HG22 ' A' ' 52' ' ' THR . 2.5 pp -144.09 168.28 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.37 -0.832 . . . . 0.0 109.947 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.521 ' O ' HG13 ' A' ' 5' ' ' VAL . 8.8 p -146.11 129.82 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.949 . . . . 0.0 110.544 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.564 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.1 OUTLIER -106.35 122.94 47.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.203 -0.936 . . . . 0.0 110.072 179.714 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.811 ' O ' HG23 ' A' ' 48' ' ' ILE . 11.8 mt -114.36 146.87 40.01 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.179 -0.951 . . . . 0.0 110.127 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.511 ' HB2' HG12 ' A' ' 48' ' ' ILE . 31.9 ttpt -141.43 165.58 27.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.186 -0.946 . . . . 0.0 110.721 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.42 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 154.28 -168.11 32.5 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.454 ' O ' ' HB ' ' A' ' 13' ' ' THR . 9.3 m-20 -64.71 142.27 58.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.183 -1.187 . . . . 0.0 109.921 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.89 -68.5 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.222 -0.924 . . . . 0.0 110.282 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 70.2 m-20 -44.27 -43.56 7.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.3 -0.875 . . . . 0.0 110.245 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.592 ' CG2' HD11 ' A' ' 72' ' ' ILE . 7.0 m -58.11 -28.52 64.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.161 -0.962 . . . . 0.0 110.309 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 11' ' ' ALA . 17.6 mt -77.17 -29.8 54.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.272 -0.892 . . . . 0.0 110.164 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 15' ' ' LYS . 13.5 ttmt -60.01 -34.59 73.56 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.288 -0.882 . . . . 0.0 110.054 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 12.3 t -70.13 -37.08 75.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.355 -0.841 . . . . 0.0 110.664 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.443 HD11 HG12 ' A' ' 72' ' ' ILE . 20.7 mt -58.98 -48.17 82.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.137 -0.977 . . . . 0.0 110.45 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.3 ttp180 -47.33 -33.46 5.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.397 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.541 ' CD1' ' C ' ' A' ' 19' ' ' TYR . 4.2 t80 -64.59 -38.44 91.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.29 -0.882 . . . . 0.0 110.305 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -69.46 -33.16 72.51 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.18 -0.95 . . . . 0.0 110.213 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.536 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.48 -31.74 72.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.191 -0.943 . . . . 0.0 110.276 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.46 -16.54 60.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.227 -0.921 . . . . 0.0 110.148 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -75.02 -41.0 60.18 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.651 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.967 ' CG ' HD12 ' A' ' 27' ' ' LEU . 5.0 m-70 -95.08 75.97 3.49 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.305 -0.872 . . . . 0.0 109.559 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 p -58.18 -6.45 0.63 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.484 -0.76 . . . . 0.0 111.933 -179.233 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.82 31.98 1.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.584 -1.322 . . . . 0.0 111.1 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.967 HD12 ' CG ' ' A' ' 24' ' ' HIS . 2.1 mt -93.1 -35.46 13.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.437 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -107.94 169.68 8.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.17 -0.957 . . . . 0.0 110.318 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.517 ' OG1' ' N ' ' A' ' 54' ' ' ASP . 36.3 m -100.2 -34.36 10.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.286 -0.884 . . . . 0.0 111.131 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.51 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.75 117.72 2.7 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.977 -1.077 . . . . 0.0 110.72 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.595 ' O ' HG13 ' A' ' 31' ' ' VAL . 4.9 p -90.69 105.64 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.127 -0.983 . . . . 0.0 109.9 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.465 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 1.4 p -68.58 155.06 40.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.142 -0.974 . . . . 0.0 110.404 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.6 p -61.37 163.83 6.22 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 109.992 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -67.99 125.58 26.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.222 -0.924 . . . . 0.0 110.471 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.527 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 25.9 p-90 -146.11 173.34 12.28 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.079 -1.013 . . . . 0.0 109.738 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.527 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 11.0 p80 -162.61 -175.38 4.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.084 -1.01 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 68.3 m95 -79.31 155.03 28.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.278 -0.889 . . . . 0.0 110.105 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -142.99 -165.14 2.0 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 127.13 -120.79 3.69 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -47.04 -24.13 0.59 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -1.139 . . . . 0.0 110.399 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.427 ' OD1' ' HG3' ' A' ' 45' ' ' LYS . 10.9 t-20 -135.68 76.25 1.6 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.265 -0.897 . . . . 0.0 110.38 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.4 m -53.99 -23.58 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.169 -0.957 . . . . 0.0 109.864 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.4 mttp -59.29 167.98 1.63 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -0.858 . . . . 0.0 109.943 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -45.89 112.35 0.46 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.24 -0.913 . . . . 0.0 109.996 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.427 ' HG3' ' OD1' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -111.49 -57.86 2.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.22 -179.882 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.515 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.5 m -145.17 67.96 1.23 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.22 -0.925 . . . . 0.0 110.407 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.491 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . -45.01 129.2 7.44 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.171 -0.956 . . . . 0.0 109.78 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.811 HG23 ' O ' ' A' ' 7' ' ' LEU . 43.6 mt -142.69 141.9 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.118 -0.989 . . . . 0.0 110.601 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 t -111.63 117.32 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.414 -0.804 . . . . 0.0 109.958 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.58 ' C ' HD12 ' A' ' 51' ' ' LEU . 50.3 m -93.69 146.58 23.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 110.008 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.58 HD12 ' C ' ' A' ' 50' ' ' THR . 5.4 mp -135.62 129.73 33.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.128 -0.983 . . . . 0.0 110.273 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.541 HG22 HG22 ' A' ' 4' ' ' ILE . 0.6 OUTLIER -97.95 136.4 38.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.548 -0.72 . . . . 0.0 110.114 179.72 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.522 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 89.9 m-85 -110.42 150.6 28.59 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.85 . . . . 0.0 109.865 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.517 ' N ' ' OG1' ' A' ' 29' ' ' THR . 1.8 t0 -84.52 -10.06 57.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.976 . . . . 0.0 110.458 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.51 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 0.4 OUTLIER -149.06 150.83 33.43 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.118 -0.989 . . . . 0.0 110.314 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.96 -56.21 9.86 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.523 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 12.3 p90 -53.95 -36.81 63.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.195 -0.941 . . . . 0.0 110.003 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.523 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 64.7 tt0 -58.32 -49.22 77.97 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.262 -0.899 . . . . 0.0 110.22 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -58.71 -36.27 73.99 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.264 -0.897 . . . . 0.0 110.112 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.661 ' HA ' HD21 ' A' ' 63' ' ' LEU . 18.8 m-20 -61.42 -42.24 98.43 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.28 -0.888 . . . . 0.0 110.528 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.49 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 62.1 mt-30 -65.92 -37.32 85.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.06 -1.025 . . . . 0.0 110.308 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.547 ' CD1' ' N ' ' A' ' 63' ' ' LEU . 10.5 t80 -55.41 -63.75 1.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.204 -0.935 . . . . 0.0 110.276 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 60' ' ' ASP . 3.2 pp -59.79 -17.1 33.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.251 -0.906 . . . . 0.0 110.585 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.443 ' HB3' ' O ' ' A' ' 60' ' ' ASP . 0.9 OUTLIER -83.87 -20.81 32.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.948 . . . . 0.0 110.434 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 41.5 mt-30 -95.53 -61.92 1.38 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.166 -0.959 . . . . 0.0 110.17 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.486 ' H ' HG22 ' A' ' 66' ' ' VAL . 15.7 m -79.63 70.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.156 -0.965 . . . . 0.0 109.876 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -44.85 117.98 1.49 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.551 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.496 HG12 ' HB ' ' A' ' 72' ' ' ILE . 0.9 OUTLIER -88.61 134.31 34.34 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 110.141 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.439 ' HG2' HD13 ' A' ' 72' ' ' ILE . 47.0 Cg_endo -55.25 176.52 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 123.875 1.46 . . . . 0.0 110.66 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.3 tptt -81.94 3.24 27.14 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.29 -33.19 24.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 109.795 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.592 HD11 ' CG2' ' A' ' 13' ' ' THR . 2.0 mp -93.92 123.21 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.412 -0.805 . . . . 0.0 109.903 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.6 m -94.61 138.17 32.81 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.46 HG22 ' N ' ' A' ' 75' ' ' SER . 7.7 p -90.86 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 0.0 111.171 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.564 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -143.69 157.57 44.3 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.736 -0.603 . . . . 0.0 110.058 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.9 p -133.13 133.12 42.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.187 -0.946 . . . . 0.0 110.172 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.7 -165.69 15.76 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' B' ' 78' ' ' PHE . 55.9 m-85 -147.88 153.63 39.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.185 -1.185 . . . . 0.0 110.356 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 93.5 mmm -139.26 152.78 47.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.219 -0.926 . . . . 0.0 110.2 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.5 t -134.96 100.57 4.62 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.229 -0.919 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 24.9 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.254 179.796 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' B' ' 2' ' ' THR . 69.6 mtm . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.236 0.541 . . . . 0.0 110.106 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' B' ' 1' ' ' MET . 54.7 m -43.79 104.25 0.37 Allowed Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.324 -0.86 . . . . 0.0 110.169 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.53 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.1 Cg_endo -55.38 157.73 14.04 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.14 1.6 . . . . 0.0 110.746 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.525 HG22 HG22 ' B' ' 52' ' ' THR . 2.6 pp -144.23 168.55 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.297 -0.877 . . . . 0.0 110.068 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.523 ' O ' HG13 ' B' ' 5' ' ' VAL . 9.4 p -146.45 129.76 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.154 -0.966 . . . . 0.0 110.552 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.572 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.1 OUTLIER -106.52 123.34 47.95 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.268 -0.895 . . . . 0.0 110.152 179.645 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.805 ' O ' HG23 ' B' ' 48' ' ' ILE . 12.1 mt -114.47 146.61 40.45 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.112 -0.992 . . . . 0.0 110.163 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.513 ' HB2' HG12 ' B' ' 48' ' ' ILE . 31.7 ttpt -141.48 165.42 27.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.08 -1.013 . . . . 0.0 110.723 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.425 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 154.44 -167.96 32.56 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 10' ' ' ASP . . . . . 0.438 ' O ' ' HB ' ' B' ' 13' ' ' THR . 8.8 m-20 -64.77 142.84 58.29 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.272 -1.134 . . . . 0.0 109.99 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.643 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.89 -68.72 0.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.231 -0.918 . . . . 0.0 110.529 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 66.3 m-20 -44.43 -43.61 7.86 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 110.358 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.601 ' CG2' HD11 ' B' ' 72' ' ' ILE . 6.3 m -57.83 -28.74 64.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.164 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' B' ' 11' ' ' ALA . 19.9 mt -76.53 -30.31 57.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' B' ' 15' ' ' LYS . 12.5 ttmt -59.96 -35.11 74.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -0.855 . . . . 0.0 110.156 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.495 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 12.0 t -69.87 -36.75 75.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.202 -0.937 . . . . 0.0 110.425 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.44 HD11 HG12 ' B' ' 72' ' ' ILE . 19.0 mt -58.81 -48.62 80.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.092 -1.005 . . . . 0.0 110.541 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 19.0 ttp180 -47.5 -32.78 5.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.17 -0.956 . . . . 0.0 110.349 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.536 ' CD1' ' C ' ' B' ' 19' ' ' TYR . 4.6 t80 -64.76 -38.12 89.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.178 -0.951 . . . . 0.0 110.329 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -69.91 -33.4 72.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.201 -0.937 . . . . 0.0 110.264 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.54 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.34 -31.42 72.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.263 -0.898 . . . . 0.0 110.375 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.39 -16.83 61.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.204 -0.935 . . . . 0.0 110.254 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -74.89 -41.17 60.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.193 -0.942 . . . . 0.0 109.75 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.971 ' CG ' HD12 ' B' ' 27' ' ' LEU . 5.1 m-70 -94.89 76.11 3.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.263 -0.898 . . . . 0.0 109.368 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.03 -6.84 0.65 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.441 -0.787 . . . . 0.0 112.088 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.67 31.88 1.65 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.589 -1.319 . . . . 0.0 111.099 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.971 HD12 ' CG ' ' B' ' 24' ' ' HIS . 2.0 mt -93.02 -34.95 13.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.057 -1.027 . . . . 0.0 110.355 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -108.04 169.96 8.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.524 ' OG1' ' N ' ' B' ' 54' ' ' ASP . 40.1 m -100.32 -34.82 9.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.28 -0.888 . . . . 0.0 111.077 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.484 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.83 118.21 2.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.965 -1.085 . . . . 0.0 110.643 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.587 ' O ' HG13 ' B' ' 31' ' ' VAL . 5.4 p -90.82 105.17 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.116 -0.99 . . . . 0.0 110.055 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.488 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 1.7 p -68.22 154.76 41.08 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.146 -0.972 . . . . 0.0 110.292 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 12.9 p -61.36 164.64 5.36 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.173 -0.954 . . . . 0.0 110.153 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.13 124.93 24.79 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.292 -0.88 . . . . 0.0 110.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.54 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 25.1 p-90 -145.57 173.5 11.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.026 -1.046 . . . . 0.0 109.789 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.54 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 10.4 p80 -162.69 -175.06 4.24 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.614 -179.601 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 67.1 m95 -79.8 155.66 27.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.333 -0.854 . . . . 0.0 110.063 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -143.64 -164.28 1.84 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.13 -0.981 . . . . 0.0 110.23 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 126.22 -117.8 2.94 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -50.22 -24.77 3.06 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.303 -1.116 . . . . 0.0 110.316 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' ASN . . . . . 0.438 ' OD1' ' HG3' ' B' ' 45' ' ' LYS . 11.5 t-20 -134.6 74.87 1.55 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.169 -0.957 . . . . 0.0 110.357 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 35.3 m -52.27 -23.7 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.265 -0.897 . . . . 0.0 110.011 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' B' ' 44' ' ' HIS . 7.4 mttp -59.78 166.86 2.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.286 -0.884 . . . . 0.0 110.152 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 44' ' ' HIS . . . . . 0.417 ' C ' ' O ' ' B' ' 43' ' ' LYS . 0.8 OUTLIER -44.31 111.96 0.36 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.176 -0.953 . . . . 0.0 109.905 179.807 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 45' ' ' LYS . . . . . 0.438 ' HG3' ' OD1' ' B' ' 41' ' ' ASN . 0.0 OUTLIER -111.65 -56.96 2.32 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.192 -0.942 . . . . 0.0 110.425 -179.802 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.518 ' O ' ' HB3' ' B' ' 36' ' ' HIS . 3.5 m -145.92 67.71 1.2 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.197 -0.939 . . . . 0.0 110.194 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.507 ' HA ' ' HB3' ' B' ' 36' ' ' HIS . . . -45.06 129.24 7.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.268 -0.895 . . . . 0.0 109.891 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.805 HG23 ' O ' ' B' ' 7' ' ' LEU . 45.1 mt -142.66 142.34 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.169 -0.957 . . . . 0.0 110.645 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 t -112.01 117.06 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.443 -0.786 . . . . 0.0 109.716 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.577 ' C ' HD12 ' B' ' 51' ' ' LEU . 54.5 m -93.15 147.4 22.91 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.251 -0.906 . . . . 0.0 109.916 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.577 HD12 ' C ' ' B' ' 50' ' ' THR . 5.3 mp -136.28 129.77 31.98 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 110.317 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.525 HG22 HG22 ' B' ' 4' ' ' ILE . 0.6 OUTLIER -98.14 136.24 38.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 179.804 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.53 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 89.1 m-85 -110.56 150.74 28.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.294 -0.879 . . . . 0.0 109.839 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.524 ' N ' ' OG1' ' B' ' 29' ' ' THR . 1.4 t0 -84.7 -10.16 57.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.133 -0.979 . . . . 0.0 110.516 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 55' ' ' SER . . . . . 0.534 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 0.4 OUTLIER -148.49 151.51 35.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.153 -0.967 . . . . 0.0 110.243 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.31 -56.03 10.0 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.279 -0.888 . . . . 0.0 109.978 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 57' ' ' TRP . . . . . 0.534 ' CE2' ' HB3' ' B' ' 55' ' ' SER . 12.3 p90 -54.21 -37.15 64.25 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 0.0 110.228 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.53 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 63.8 tt0 -58.37 -48.32 80.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -0.929 . . . . 0.0 110.206 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -59.14 -36.59 75.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.149 -0.969 . . . . 0.0 110.154 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.637 ' HA ' HD21 ' B' ' 63' ' ' LEU . 19.3 m-20 -61.31 -41.91 97.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 110.437 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 61.6 mt-30 -65.91 -37.32 85.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 0.0 110.145 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.546 ' CD1' ' N ' ' B' ' 63' ' ' LEU . 10.5 t80 -55.64 -63.57 1.13 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.116 -0.99 . . . . 0.0 110.262 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.637 HD21 ' HA ' ' B' ' 60' ' ' ASP . 3.3 pp -59.93 -16.65 31.48 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.272 -0.892 . . . . 0.0 110.516 -179.487 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' B' ' 60' ' ' ASP . 1.0 OUTLIER -84.5 -21.09 30.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.244 -0.91 . . . . 0.0 110.376 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 65' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 39.3 mt-30 -95.22 -62.85 1.23 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.982 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.477 ' H ' HG22 ' B' ' 66' ' ' VAL . 16.3 m -78.57 70.88 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.049 -1.032 . . . . 0.0 109.816 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -45.75 118.37 1.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.289 -0.882 . . . . 0.0 110.472 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.478 HG12 ' HB ' ' B' ' 72' ' ' ILE . 0.9 OUTLIER -88.71 134.91 32.94 Favored Pre-proline 0 N--CA 1.486 1.35 0 O-C-N 121.232 -0.917 . . . . 0.0 110.331 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.464 ' HG2' HD13 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -55.88 176.8 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.048 1.552 . . . . 0.0 110.663 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -82.61 3.23 29.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.351 -0.843 . . . . 0.0 110.356 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -32.79 24.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.131 -0.981 . . . . 0.0 109.696 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.601 HD11 ' CG2' ' B' ' 13' ' ' THR . 2.0 mp -94.48 123.61 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.552 -0.717 . . . . 0.0 109.985 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.5 m -95.06 138.42 32.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.155 -0.965 . . . . 0.0 109.982 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.455 HG22 ' N ' ' B' ' 75' ' ' SER . 7.4 p -90.78 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.151 -0.968 . . . . 0.0 110.995 -178.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 75' ' ' SER . . . . . 0.572 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.62 157.65 44.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.763 -0.585 . . . . 0.0 110.173 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.2 p -133.49 133.57 42.39 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.0 110.281 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.87 -165.15 14.89 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 78' ' ' PHE . 55.7 m-85 -148.15 153.12 38.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.176 -1.19 . . . . 0.0 110.207 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 95.1 mmm -138.59 152.68 48.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t -135.09 100.58 4.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 110.338 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.173 179.945 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.7 mtp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.183 0.516 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.29 132.84 43.93 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.002 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.49 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 43.1 Cg_endo -91.2 166.19 3.65 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.78 1.411 . . . . 0.0 110.668 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.438 HG21 ' HG3' ' A' ' 79' ' ' MET . 1.4 pt -144.05 179.62 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.408 -0.808 . . . . 0.0 110.154 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.534 HG13 ' CG2' ' A' ' 74' ' ' VAL . 1.0 OUTLIER -146.33 129.88 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.245 -0.909 . . . . 0.0 110.193 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.563 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.38 121.48 43.99 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.308 -0.87 . . . . 0.0 110.088 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 1.058 ' O ' HG23 ' A' ' 48' ' ' ILE . 4.2 tp -119.74 139.92 51.53 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.192 -0.943 . . . . 0.0 110.148 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.514 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.6 ttpp -142.39 167.13 22.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 0.0 110.573 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.514 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 154.74 -166.49 32.39 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.489 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 65.4 m-20 -64.65 136.73 57.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -1.233 . . . . 0.0 109.968 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.409 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.78 -46.57 59.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 111.169 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -63.51 -46.8 84.38 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.118 -0.989 . . . . 0.0 111.196 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.489 ' OG1' ' HB2' ' A' ' 10' ' ' ASP . 6.4 m -57.72 -31.19 66.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.901 -1.125 . . . . 0.0 110.383 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.483 HD12 ' O ' ' A' ' 10' ' ' ASP . 6.7 mt -75.06 -25.44 58.63 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -59.46 -40.63 87.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.545 -0.722 . . . . 0.0 110.294 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 22.4 t -70.12 -36.89 75.14 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.222 -0.924 . . . . 0.0 110.527 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 mt -58.85 -54.79 43.09 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.085 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.493 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 26.9 ttt180 -47.28 -26.29 1.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.54 -0.725 . . . . 0.0 110.762 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.489 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 10.9 t80 -64.92 -50.9 64.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 0.0 110.747 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.48 -13.54 62.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.474 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.493 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 2.4 m-30 -66.33 -35.4 80.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.203 -0.936 . . . . 0.0 110.076 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.514 ' HE2' ' NE2' ' B' ' 40' ' ' HIS . 26.3 mmmt -63.52 -29.83 71.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.32 -0.862 . . . . 0.0 110.261 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -74.91 -41.09 60.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.21 -0.931 . . . . 0.0 109.762 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.705 ' HB3' HD22 ' A' ' 27' ' ' LEU . 68.2 m-70 -95.14 37.27 1.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.32 -0.863 . . . . 0.0 109.94 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.605 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 8.7 p -57.22 -14.35 4.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.311 -0.868 . . . . 0.0 110.428 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 p -96.72 6.67 48.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.103 -0.998 . . . . 0.0 110.182 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' A' ' 24' ' ' HIS . 6.6 mp -92.39 -35.04 13.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 110.376 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 39.3 p90 -111.05 165.77 11.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.189 -0.944 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.06 -30.47 12.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.233 -0.917 . . . . 0.0 110.737 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.568 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.66 114.48 2.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.226 -0.921 . . . . 0.0 110.557 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.766 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.7 p -89.98 99.69 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.119 -0.988 . . . . 0.0 110.135 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.481 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -50.74 147.9 4.44 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.217 -0.927 . . . . 0.0 110.179 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t -60.82 164.47 4.75 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.085 -1.01 . . . . 0.0 109.829 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.7 121.21 15.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.173 -0.954 . . . . 0.0 110.255 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.532 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 55.7 p-90 -145.03 -177.56 5.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 109.605 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.501 ' CD2' ' C ' ' A' ' 35' ' ' TRP . 0.8 OUTLIER -162.68 170.73 17.97 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.027 -1.045 . . . . 0.0 110.422 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.418 ' CZ2' ' HH2' ' A' ' 35' ' ' TRP . 26.3 m95 -79.37 105.23 10.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.337 -0.852 . . . . 0.0 110.033 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.588 ' O ' HG13 ' B' ' 31' ' ' VAL . 9.0 t -171.26 175.0 4.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.272 -0.893 . . . . 0.0 110.315 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -121.58 -76.06 0.4 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -98.99 -87.38 0.35 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.206 -1.173 . . . . 0.0 109.943 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -116.85 153.34 32.69 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.327 -0.858 . . . . 0.0 109.985 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -141.57 127.72 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.1 -1.0 . . . . 0.0 110.171 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -85.52 -17.42 36.45 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.301 -0.874 . . . . 0.0 110.19 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -79.44 -139.4 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 0.0 110.085 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.8 mmmt -108.37 152.98 23.92 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.229 -0.919 . . . . 0.0 110.154 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.435 ' C ' ' HB3' ' A' ' 36' ' ' HIS . 0.1 OUTLIER -162.38 82.37 0.54 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.873 . . . . 0.0 110.032 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -157.1 102.46 1.97 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 110.268 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 1.058 HG23 ' O ' ' A' ' 7' ' ' LEU . 19.1 mt -141.96 148.81 20.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.336 -0.852 . . . . 0.0 109.678 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.2 t -126.69 113.12 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.104 -0.998 . . . . 0.0 110.654 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.414 ' O ' ' HG ' ' A' ' 51' ' ' LEU . 94.6 m -93.86 156.88 16.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 109.809 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 50' ' ' THR . 1.6 mp -137.36 139.86 41.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.565 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.568 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 0.0 OUTLIER -96.54 125.08 40.77 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.653 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.49 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 28.3 m-85 -107.79 148.71 29.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.445 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.51 -16.78 28.24 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 85.0 p -147.61 148.15 30.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.148 -0.97 . . . . 0.0 110.178 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 16.0 mt-10 -70.16 -36.97 75.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.209 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 43.2 t-105 -53.78 -48.0 70.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.296 -0.877 . . . . 0.0 109.988 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 55.2 tt0 -57.07 -36.05 70.09 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.312 -0.867 . . . . 0.0 110.53 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.444 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 1.1 ttp180 -59.62 -44.93 93.29 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.208 -0.933 . . . . 0.0 110.948 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -61.3 -40.58 94.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.111 -0.993 . . . . 0.0 111.391 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.443 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 37.3 mt-30 -65.42 -43.33 90.85 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.886 -1.134 . . . . 0.0 110.743 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.801 ' O ' HG22 ' A' ' 66' ' ' VAL . 15.9 t80 -55.96 -51.72 66.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.23 -0.919 . . . . 0.0 110.789 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 43.1 mt -59.61 -14.74 14.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.199 -0.938 . . . . 0.0 110.605 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.8 t -96.44 -21.91 17.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.897 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 4.8 mt-30 -95.85 -34.19 11.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.071 -1.018 . . . . 0.0 110.438 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.801 HG22 ' O ' ' A' ' 62' ' ' PHE . 19.5 m -87.03 109.12 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.101 -0.999 . . . . 0.0 110.624 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.3 137.33 36.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.561 HD11 HG21 ' A' ' 72' ' ' ILE . 18.2 tt -150.37 131.57 7.41 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.011 -1.055 . . . . 0.0 110.739 -179.202 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.626 ' HG2' HG22 ' A' ' 71' ' ' THR . 43.6 Cg_endo -47.28 -178.39 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 124.246 1.656 . . . . 0.0 111.063 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.54 6.06 45.17 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.235 -0.915 . . . . 0.0 110.377 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.862 HG23 HG12 ' A' ' 72' ' ' ILE . 9.8 t -84.21 -30.38 25.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.063 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.862 HG12 HG23 ' A' ' 71' ' ' THR . 17.3 mm -94.86 103.23 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.4 m -95.35 157.78 15.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.243 -0.911 . . . . 0.0 109.997 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.615 ' HB ' HD12 ' A' ' 7' ' ' LEU . 9.8 p -145.85 157.88 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.147 -0.971 . . . . 0.0 110.592 -179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.59 -179.13 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.452 -0.78 . . . . 0.0 110.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 p -107.4 170.46 7.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.109 -0.994 . . . . 0.0 110.79 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.427 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -164.4 -174.07 33.76 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' B' ' 78' ' ' PHE . 38.6 m-85 -148.1 142.08 25.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.223 -1.163 . . . . 0.0 110.69 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.438 ' HG3' HG21 ' A' ' 4' ' ' ILE . 90.3 mmm -122.94 156.91 33.75 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 110.042 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.415 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -135.62 102.74 5.2 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.349 -0.844 . . . . 0.0 110.146 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.415 HG23 ' C ' ' A' ' 80' ' ' SER . 14.4 pt . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.289 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.185 0.517 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.54 132.99 42.96 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 109.964 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.497 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 44.2 Cg_endo -91.8 165.9 3.29 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.923 1.486 . . . . 0.0 110.678 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.453 HG21 ' HG3' ' B' ' 79' ' ' MET . 1.4 pt -144.18 -179.92 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.354 -0.841 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.537 HG13 ' CG2' ' B' ' 74' ' ' VAL . 1.0 OUTLIER -146.59 130.94 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.119 -0.988 . . . . 0.0 110.213 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.574 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.0 OUTLIER -106.06 121.69 44.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.124 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 1.043 ' O ' HG23 ' B' ' 48' ' ' ILE . 4.2 tp -119.79 139.94 51.54 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.216 -0.928 . . . . 0.0 110.1 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.508 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 9.9 ttpp -142.55 167.36 22.27 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.11 -0.994 . . . . 0.0 110.534 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.508 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 154.74 -166.34 32.34 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 10' ' ' ASP . . . . . 0.499 ' HB2' ' OG1' ' B' ' 13' ' ' THR . 67.2 m-20 -64.99 136.42 56.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.129 -1.218 . . . . 0.0 109.752 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.431 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.57 -45.53 57.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 111.297 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -64.38 -46.3 83.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.121 -0.987 . . . . 0.0 111.117 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.499 ' OG1' ' HB2' ' B' ' 10' ' ' ASP . 6.5 m -57.87 -31.57 66.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.026 -1.046 . . . . 0.0 110.345 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.461 HD12 ' O ' ' B' ' 10' ' ' ASP . 6.2 mt -74.93 -25.13 58.68 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.211 -0.931 . . . . 0.0 109.548 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.58 -40.31 86.98 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.438 -0.789 . . . . 0.0 110.069 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.491 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.0 t -70.21 -37.25 75.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.308 -0.87 . . . . 0.0 110.473 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 17.1 mt -58.81 -54.62 45.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.19 -0.944 . . . . 0.0 110.17 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.501 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 27.6 ttt180 -47.19 -26.19 1.1 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.494 -0.754 . . . . 0.0 110.77 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.491 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 11.1 t80 -65.03 -50.79 64.86 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.038 -1.039 . . . . 0.0 110.79 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.66 -13.39 62.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.168 -0.958 . . . . 0.0 110.539 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.501 ' HB2' ' O ' ' B' ' 18' ' ' ARG . 2.4 m-30 -66.48 -35.62 80.73 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.15 -0.969 . . . . 0.0 110.262 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -63.33 -29.87 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.188 -0.945 . . . . 0.0 110.37 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -74.85 -41.26 60.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.108 -0.995 . . . . 0.0 109.831 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.721 ' HB3' HD22 ' B' ' 27' ' ' LEU . 66.7 m-70 -95.09 37.05 1.17 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.34 -0.85 . . . . 0.0 109.861 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.611 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 7.7 p -57.07 -14.44 3.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.376 -0.827 . . . . 0.0 110.457 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 27.5 p -96.35 6.77 48.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.168 -0.957 . . . . 0.0 110.103 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.721 HD22 ' HB3' ' B' ' 24' ' ' HIS . 6.5 mp -92.54 -35.5 13.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.315 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.611 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 37.5 p90 -110.54 166.21 11.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.147 -0.971 . . . . 0.0 110.197 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.7 -30.24 12.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.296 -0.878 . . . . 0.0 110.766 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.586 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.56 114.15 2.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.13 -0.981 . . . . 0.0 110.49 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.762 ' O ' HG13 ' B' ' 31' ' ' VAL . 12.1 p -90.02 99.36 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.097 -1.002 . . . . 0.0 109.725 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.532 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -50.87 148.28 4.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.117 -0.99 . . . . 0.0 110.102 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 33' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' A' ' 35' ' ' TRP . 3.9 t -60.98 164.62 4.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.894 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.6 m -67.69 121.71 16.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.237 -0.914 . . . . 0.0 110.319 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.5 ' C ' ' CD2' ' B' ' 36' ' ' HIS . 56.6 p-90 -145.34 -177.13 5.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.149 -0.969 . . . . 0.0 109.741 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.5 ' CD2' ' C ' ' B' ' 35' ' ' TRP . 0.7 OUTLIER -162.67 170.45 18.43 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.033 -1.042 . . . . 0.0 110.41 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.428 ' CZ3' ' OG1' ' A' ' 52' ' ' THR . 26.4 m95 -79.26 104.93 10.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.678 ' O ' HG13 ' A' ' 31' ' ' VAL . 8.8 t -171.21 174.71 4.5 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.297 -0.877 . . . . 0.0 110.185 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -121.6 -76.41 0.41 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.456 -1.457 . . . . 0.0 109.456 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' HIS . . . . . 0.514 ' NE2' ' HE2' ' A' ' 22' ' ' LYS . 6.8 m-70 -98.11 -87.63 0.33 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.248 -1.148 . . . . 0.0 110.153 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -117.18 152.74 34.15 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.325 -0.86 . . . . 0.0 110.05 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.78 127.65 21.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.212 -0.93 . . . . 0.0 110.373 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -85.32 -18.18 34.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.334 -0.853 . . . . 0.0 109.986 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -78.45 -139.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.877 . . . . 0.0 110.079 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 15.4 mmmt -108.6 151.44 26.12 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.172 -0.955 . . . . 0.0 110.085 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.441 ' C ' ' HB3' ' B' ' 36' ' ' HIS . 0.1 OUTLIER -160.88 82.12 0.65 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.195 -0.941 . . . . 0.0 110.135 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -156.64 102.15 2.03 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.241 -0.912 . . . . 0.0 110.416 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 1.043 HG23 ' O ' ' B' ' 7' ' ' LEU . 19.7 mt -141.64 149.16 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 109.704 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 93.1 t -126.91 113.28 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.112 -0.992 . . . . 0.0 110.626 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.41 ' O ' ' HG ' ' B' ' 51' ' ' LEU . 97.7 m -94.26 156.86 16.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 109.899 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' B' ' 50' ' ' THR . 1.7 mp -137.22 139.84 41.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.045 -1.034 . . . . 0.0 110.623 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.586 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 0.0 OUTLIER -96.67 125.18 40.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.728 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.497 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 28.9 m-85 -107.99 149.08 28.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 0.0 110.528 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.84 -16.59 28.01 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.407 -0.808 . . . . 0.0 110.17 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 85.1 p -147.83 146.7 29.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.453 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 15.6 mt-10 -68.71 -37.64 79.65 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.152 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 44.3 t-105 -53.7 -48.32 69.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.318 -0.864 . . . . 0.0 110.112 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.491 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.5 tt0 -56.8 -35.72 69.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.408 -0.807 . . . . 0.0 110.453 -179.203 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.462 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 1.1 ttp180 -59.83 -45.44 92.39 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.042 -1.036 . . . . 0.0 110.979 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -60.95 -40.23 92.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.163 -0.96 . . . . 0.0 111.235 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 37.8 mt-30 -65.62 -43.44 89.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.051 -1.031 . . . . 0.0 110.73 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.793 ' O ' HG22 ' B' ' 66' ' ' VAL . 17.1 t80 -55.88 -51.66 66.79 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.286 -0.884 . . . . 0.0 110.672 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.78 -15.51 20.98 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.134 -0.979 . . . . 0.0 110.765 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 10.6 t -95.49 -21.99 17.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.117 -0.989 . . . . 0.0 110.974 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 4.6 mt-30 -95.91 -33.06 12.33 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.079 -1.013 . . . . 0.0 110.545 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.793 HG22 ' O ' ' B' ' 62' ' ' PHE . 20.1 m -88.3 109.43 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.208 -0.932 . . . . 0.0 110.616 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.97 137.29 36.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.945 . . . . 0.0 109.507 179.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.556 HD11 HG21 ' B' ' 72' ' ' ILE . 18.4 tt -150.3 131.68 7.5 Favored Pre-proline 0 C--N 1.305 -1.369 0 O-C-N 120.993 -1.067 . . . . 0.0 110.518 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.615 ' HG2' HG22 ' B' ' 71' ' ' THR . 42.2 Cg_endo -47.93 -179.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.711 0 O-C-N 124.148 1.604 . . . . 0.0 110.942 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -89.48 5.75 43.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.37 -0.831 . . . . 0.0 110.481 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 71' ' ' THR . . . . . 0.874 HG23 HG12 ' B' ' 72' ' ' ILE . 9.4 t -84.17 -30.58 25.71 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.158 -0.964 . . . . 0.0 110.227 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.874 HG12 HG23 ' B' ' 71' ' ' THR . 16.8 mm -94.6 103.52 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -0.926 . . . . 0.0 110.254 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 63.2 m -95.41 157.39 15.92 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.237 -0.914 . . . . 0.0 110.204 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.616 ' HB ' HD12 ' B' ' 7' ' ' LEU . 9.8 p -145.64 157.49 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.059 -1.026 . . . . 0.0 110.743 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.3 -178.99 5.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.496 -0.753 . . . . 0.0 109.875 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.5 p -107.15 171.91 7.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.102 -0.999 . . . . 0.0 110.773 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.447 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -164.98 -175.1 35.4 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' A' ' 78' ' ' PHE . 36.8 m-85 -147.8 140.57 24.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -1.133 . . . . 0.0 110.462 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.453 ' HG3' HG21 ' B' ' 4' ' ' ILE . 89.6 mmm -121.99 157.53 31.12 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 110.033 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.407 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.3 OUTLIER -135.84 103.51 5.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.239 -0.913 . . . . 0.0 110.178 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.407 HG23 ' C ' ' B' ' 80' ' ' SER . 13.8 pt . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.18 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.252 0.549 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 m -72.33 123.62 89.74 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.286 -0.884 . . . . 0.0 110.256 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.562 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.7 Cg_endo -76.92 153.06 32.6 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 O-C-N 123.947 1.498 . . . . 0.0 110.296 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.653 HD11 ' HA3' ' A' ' 77' ' ' GLY . 0.8 OUTLIER -144.2 176.4 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.482 HG23 ' HB2' ' A' ' 51' ' ' LEU . 2.4 m -146.33 129.05 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.313 -0.867 . . . . 0.0 110.214 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.494 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 1.1 m170 -104.98 116.51 32.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.936 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.582 HD12 ' O ' ' A' ' 49' ' ' VAL . 1.0 OUTLIER -109.75 142.51 40.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.225 -0.922 . . . . 0.0 110.142 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.914 ' HD3' HD11 ' A' ' 48' ' ' ILE . 14.9 ttpt -141.5 166.48 24.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.261 -0.899 . . . . 0.0 110.492 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.25 -160.05 29.23 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.04 136.52 56.86 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -1.183 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.99 -29.59 8.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.301 -0.874 . . . . 0.0 110.52 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -78.01 -46.3 21.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.106 -0.996 . . . . 0.0 110.173 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.7 m -58.1 -14.08 6.09 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.389 -0.82 . . . . 0.0 110.419 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.561 ' HA ' HD12 ' A' ' 17' ' ' LEU . 16.0 mt -87.62 -38.39 15.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 110.423 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.03 -37.39 79.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.221 -0.924 . . . . 0.0 110.227 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 8.0 t -70.08 -37.29 75.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.317 -0.864 . . . . 0.0 110.558 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.599 HD11 HG13 ' A' ' 72' ' ' ILE . 19.1 mt -58.75 -48.84 79.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.079 -1.013 . . . . 0.0 110.223 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.587 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 19.5 ttm180 -47.69 -37.3 12.74 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.253 -0.905 . . . . 0.0 110.253 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 18.1 t80 -64.76 -31.25 72.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 0.0 110.627 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.451 ' NH1' ' HE3' ' A' ' 67' ' ' LYS . 6.2 mmt180 -70.42 -30.54 67.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.147 -0.971 . . . . 0.0 110.205 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.587 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.1 m-30 -66.63 -17.26 64.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.894 . . . . 0.0 110.327 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.8 mmtt -63.63 -33.0 74.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.305 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.509 ' O ' ' ND1' ' A' ' 24' ' ' HIS . 4.1 mmtp -75.03 -10.87 59.88 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.205 -0.934 . . . . 0.0 110.225 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.875 ' CB ' HD22 ' A' ' 27' ' ' LEU . 8.0 m-70 -144.7 46.32 1.37 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.215 -0.928 . . . . 0.0 109.928 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.534 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 11.3 t -57.43 -14.87 5.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.464 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -96.48 17.01 17.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.139 -0.976 . . . . 0.0 110.325 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.875 HD22 ' CB ' ' A' ' 24' ' ' HIS . 5.0 mp -92.41 -35.11 13.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.248 -0.908 . . . . 0.0 110.017 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.534 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 16.8 p90 -108.03 172.75 6.66 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.208 -0.933 . . . . 0.0 109.994 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 96.4 m -99.82 -32.05 11.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.198 -0.938 . . . . 0.0 111.372 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.75 119.89 3.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.859 -1.151 . . . . 0.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.644 ' O ' HG13 ' A' ' 31' ' ' VAL . 9.4 p -89.1 114.9 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 109.655 179.213 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.614 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -83.79 152.78 24.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.149 -0.969 . . . . 0.0 110.671 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.4 p -61.36 164.79 5.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.322 -0.861 . . . . 0.0 110.425 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 m -68.12 126.17 28.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.355 -0.841 . . . . 0.0 110.239 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.592 ' CZ3' ' CB ' ' B' ' 32' ' ' SER . 1.6 p-90 -145.46 164.4 31.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.042 -1.036 . . . . 0.0 109.438 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.45 ' HE1' HG21 ' A' ' 38' ' ' THR . 2.1 p80 -162.45 -178.72 6.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.967 -1.083 . . . . 0.0 110.973 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.481 ' O ' ' HB ' ' A' ' 38' ' ' THR . 33.7 m95 -79.55 126.49 30.94 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.525 -0.734 . . . . 0.0 110.664 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.481 ' HB ' ' O ' ' A' ' 37' ' ' TRP . 0.6 OUTLIER 178.72 152.48 0.34 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.329 -0.857 . . . . 0.0 110.063 179.53 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -81.83 -41.9 9.35 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.78 ' O ' HG13 ' A' ' 42' ' ' VAL . 12.1 t-80 -159.81 176.98 11.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -1.162 . . . . 0.0 110.104 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -54.64 86.2 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.128 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.78 HG13 ' O ' ' A' ' 40' ' ' HIS . 12.7 m -122.11 -17.72 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.885 . . . . 0.0 110.122 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 42' ' ' VAL . 0.4 OUTLIER -147.47 132.7 18.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.302 -0.874 . . . . 0.0 110.13 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -101.1 4.33 42.08 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.19 -0.944 . . . . 0.0 110.375 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' A' ' 46' ' ' SER . 27.7 tttp -81.67 -60.07 2.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.242 -0.911 . . . . 0.0 110.201 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.469 ' O ' ' HB2' ' A' ' 47' ' ' ALA . 0.4 OUTLIER -43.36 149.64 0.24 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.134 -0.979 . . . . 0.0 110.143 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 46' ' ' SER . . . -178.63 126.04 0.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 110.156 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.914 HD11 ' HD3' ' A' ' 8' ' ' LYS . 20.0 mt -142.49 147.31 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 0.0 110.248 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.582 ' O ' HD12 ' A' ' 7' ' ' LEU . 21.3 t -125.36 119.93 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.294 -0.879 . . . . 0.0 110.234 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.494 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 16.0 m -94.22 151.86 19.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.256 -0.902 . . . . 0.0 110.132 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.482 ' HB2' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -137.08 131.73 33.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 110.07 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.473 ' HA ' HG22 ' A' ' 4' ' ' ILE . 40.2 p -97.77 136.37 38.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -0.833 . . . . 0.0 110.239 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.562 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 37.5 m-85 -116.16 153.99 30.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.0 110.125 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -89.92 -13.88 35.37 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.25 -0.907 . . . . 0.0 110.768 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.591 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 1.7 m -142.28 151.13 41.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.044 -1.035 . . . . 0.0 110.221 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -70.97 -53.9 13.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.668 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 6.9 p90 -54.03 -35.16 61.64 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.098 -1.001 . . . . 0.0 110.063 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.668 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 33.3 tt0 -56.89 -37.76 71.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 110.024 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -59.59 -40.21 86.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.658 ' HA ' HD12 ' A' ' 63' ' ' LEU . 96.5 m-20 -61.08 -40.36 93.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.329 -0.857 . . . . 0.0 110.458 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.489 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 40.5 mt-30 -65.66 -40.68 92.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.224 -0.923 . . . . 0.0 110.36 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.681 ' CE2' HG21 ' A' ' 66' ' ' VAL . 85.9 t80 -55.7 -39.81 71.54 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.108 -0.995 . . . . 0.0 109.531 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 60' ' ' ASP . 62.2 mt -58.89 -27.64 65.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.389 -0.819 . . . . 0.0 109.713 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 8.5 p -96.37 -6.21 38.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 109.794 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.517 ' CG ' HD21 ' A' ' 27' ' ' LEU . 20.0 mm-40 -95.23 -28.36 15.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.394 -0.817 . . . . 0.0 109.741 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.722 ' O ' HG23 ' A' ' 66' ' ' VAL . 33.3 m -131.26 85.47 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.324 -0.86 . . . . 0.0 109.863 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.451 ' HE3' ' NH1' ' A' ' 20' ' ' ARG . 7.4 pttp -41.85 135.82 2.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.237 -0.914 . . . . 0.0 110.423 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.487 HD12 ' O ' ' A' ' 66' ' ' VAL . 1.4 mp -88.41 148.69 42.94 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.369 -0.832 . . . . 0.0 110.126 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.527 ' CG ' ' CG1' ' A' ' 72' ' ' ILE . 46.3 Cg_endo -70.81 -160.06 0.07 OUTLIER 'Trans proline' 0 C--N 1.302 -1.872 0 O-C-N 124.163 1.612 . . . . 0.0 110.579 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.551 ' O ' HG23 ' A' ' 71' ' ' THR . 0.3 OUTLIER -104.9 24.61 11.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.551 HG23 ' O ' ' A' ' 70' ' ' LYS . 1.9 p -154.42 3.15 0.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 111.441 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.75 HD13 ' O ' ' A' ' 8' ' ' LYS . 9.6 mm -95.12 121.16 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.807 -1.183 . . . . 0.0 109.901 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.469 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 1.7 m -94.86 129.81 41.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 110.29 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.562 ' O ' HG13 ' A' ' 74' ' ' VAL . 2.9 p -112.02 100.37 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.476 -0.765 . . . . 0.0 109.822 178.513 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.02 175.99 5.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.746 -1.221 . . . . 0.0 110.536 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.9 p -109.06 153.26 23.9 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.025 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.653 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -162.16 178.36 38.0 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -147.84 139.14 23.58 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.269 -1.136 . . . . 0.0 110.263 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.417 ' SD ' ' CE1' ' B' ' 6' ' ' HIS . 2.1 mtm -126.01 138.21 53.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.108 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.26 101.82 6.91 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.23 -0.918 . . . . 0.0 110.336 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.19 179.879 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.244 0.545 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 3.0 m -71.96 123.76 89.91 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 110.279 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -76.97 153.21 32.47 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 123.997 1.525 . . . . 0.0 110.262 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.659 HD11 ' HA3' ' B' ' 77' ' ' GLY . 0.7 OUTLIER -144.28 176.07 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.324 -0.86 . . . . 0.0 110.245 179.822 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.467 HG23 ' HB2' ' B' ' 51' ' ' LEU . 2.5 m -146.05 128.86 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.33 -0.856 . . . . 0.0 110.179 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.469 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.1 m170 -104.57 118.57 36.92 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.255 -0.903 . . . . 0.0 109.624 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.573 HD12 ' O ' ' B' ' 49' ' ' VAL . 1.0 OUTLIER -111.69 142.37 44.11 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.426 -0.796 . . . . 0.0 110.139 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.91 ' HD3' HD11 ' B' ' 48' ' ' ILE . 15.0 ttpt -141.64 166.05 25.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.85 -160.14 29.48 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.98 136.17 56.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.279 -1.13 . . . . 0.0 110.158 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.83 -30.19 9.37 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.271 -0.893 . . . . 0.0 110.305 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -76.82 -46.76 23.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.254 -0.904 . . . . 0.0 110.223 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -57.96 -15.24 8.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.32 -0.862 . . . . 0.0 110.533 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' B' ' 17' ' ' LEU . 16.6 mt -86.4 -38.07 17.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 110.561 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.1 -37.53 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.199 -0.938 . . . . 0.0 110.325 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.471 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 8.4 t -69.93 -37.22 75.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.919 . . . . 0.0 110.344 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' B' ' 14' ' ' LEU . 19.8 mt -58.69 -49.03 79.07 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.231 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.584 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 19.1 ttm180 -47.93 -36.62 12.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.409 -0.807 . . . . 0.0 110.151 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.471 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 21.9 t80 -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.427 -0.796 . . . . 0.0 110.503 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 20' ' ' ARG . . . . . 0.457 ' NH1' ' HE3' ' B' ' 67' ' ' LYS . 6.3 mmt180 -69.83 -31.05 68.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.228 -0.92 . . . . 0.0 110.33 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.584 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.2 m-30 -66.4 -17.21 64.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.199 -0.938 . . . . 0.0 110.317 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -63.46 -32.83 74.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.26 -0.9 . . . . 0.0 110.191 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' LYS . . . . . 0.507 ' O ' ' ND1' ' B' ' 24' ' ' HIS . 4.0 mmtp -75.26 -10.67 59.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.208 -0.933 . . . . 0.0 110.214 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.877 ' CB ' HD22 ' B' ' 27' ' ' LEU . 8.6 m-70 -145.06 46.46 1.33 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.229 -0.919 . . . . 0.0 109.998 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.567 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 13.9 t -57.29 -14.54 4.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.258 -0.902 . . . . 0.0 110.565 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -96.59 16.26 19.35 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.251 -0.905 . . . . 0.0 110.294 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.877 HD22 ' CB ' ' B' ' 24' ' ' HIS . 5.2 mp -92.12 -34.08 14.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 110.025 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.567 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 17.1 p90 -108.37 172.54 6.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.9 . . . . 0.0 110.048 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -99.97 -32.11 11.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.157 -0.965 . . . . 0.0 111.283 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.86 119.88 2.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.899 -1.126 . . . . 0.0 111.013 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.632 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.3 p -89.46 115.2 28.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.277 -0.889 . . . . 0.0 109.567 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.592 ' CB ' ' CZ3' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -83.92 153.34 24.01 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.204 -0.935 . . . . 0.0 110.74 -179.417 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 60.3 p -61.56 164.44 5.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.328 -0.858 . . . . 0.0 110.314 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -68.05 126.45 29.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.287 -0.883 . . . . 0.0 110.25 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.614 ' CZ3' ' CB ' ' A' ' 32' ' ' SER . 1.7 p-90 -145.71 164.93 30.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.014 -1.054 . . . . 0.0 109.567 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.438 ' HE1' HG21 ' B' ' 38' ' ' THR . 2.3 p80 -162.46 -177.91 5.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.951 -1.093 . . . . 0.0 110.972 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.496 ' O ' ' HB ' ' B' ' 38' ' ' THR . 34.1 m95 -79.87 127.0 31.72 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.415 -0.803 . . . . 0.0 110.507 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.567 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.6 OUTLIER 178.12 151.88 0.27 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.271 -0.893 . . . . 0.0 110.167 179.492 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -81.13 -42.67 9.27 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' HIS . . . . . 0.733 ' O ' HG13 ' B' ' 42' ' ' VAL . 11.4 t-80 -159.11 178.06 10.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.194 -1.18 . . . . 0.0 110.206 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -55.42 85.17 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.271 -0.893 . . . . 0.0 110.074 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.733 HG13 ' O ' ' B' ' 40' ' ' HIS . 13.5 m -121.21 -17.66 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.174 -0.954 . . . . 0.0 110.367 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -147.4 132.74 18.52 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.25 -0.907 . . . . 0.0 109.968 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -100.91 3.63 41.93 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.255 -0.903 . . . . 0.0 110.373 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 45' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' B' ' 46' ' ' SER . 28.1 tttp -80.84 -61.14 2.05 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.209 -0.932 . . . . 0.0 110.146 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.479 ' O ' ' HB2' ' B' ' 47' ' ' ALA . 0.3 OUTLIER -42.45 149.68 0.16 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.295 -0.878 . . . . 0.0 110.297 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' B' ' 46' ' ' SER . . . -178.91 126.1 0.1 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.279 -0.888 . . . . 0.0 110.191 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.91 HD11 ' HD3' ' B' ' 8' ' ' LYS . 20.1 mt -142.48 146.84 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.274 -0.891 . . . . 0.0 110.318 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 49' ' ' VAL . . . . . 0.573 ' O ' HD12 ' B' ' 7' ' ' LEU . 21.4 t -124.65 120.31 58.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.469 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 16.7 m -94.35 151.22 19.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.073 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.477 HD23 ' HB2' ' B' ' 28' ' ' TYR . 0.2 OUTLIER -136.83 131.76 33.7 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.927 . . . . 0.0 110.165 179.709 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.445 ' HA ' HG22 ' B' ' 4' ' ' ILE . 40.8 p -98.01 136.2 38.62 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.368 -0.833 . . . . 0.0 110.364 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.561 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 37.6 m-85 -116.18 154.13 30.6 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 110.147 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -90.07 -14.38 33.92 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.175 -0.953 . . . . 0.0 110.736 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' SER . . . . . 0.607 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 1.7 m -141.39 151.73 43.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.105 -0.997 . . . . 0.0 110.21 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -71.92 -53.55 12.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.23 -0.919 . . . . 0.0 110.37 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' TRP . . . . . 0.67 ' CD1' ' N ' ' B' ' 58' ' ' GLN . 6.3 p90 -53.92 -34.84 60.74 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.109 -0.995 . . . . 0.0 109.945 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.67 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 32.5 tt0 -57.0 -38.31 72.91 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.08 -1.012 . . . . 0.0 110.033 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -59.48 -39.71 84.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.226 -0.921 . . . . 0.0 109.927 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.637 ' HA ' HD12 ' B' ' 63' ' ' LEU . 96.6 m-20 -61.31 -39.97 92.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.317 -0.865 . . . . 0.0 110.216 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 65.3 mt-30 -65.85 -41.31 91.87 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.475 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.658 ' CE2' HG21 ' B' ' 66' ' ' VAL . 85.8 t80 -55.62 -39.5 70.89 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.196 -0.94 . . . . 0.0 109.53 179.657 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.637 HD12 ' HA ' ' B' ' 60' ' ' ASP . 67.1 mt -58.89 -27.25 65.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.472 -0.767 . . . . 0.0 109.827 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.433 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 6.5 p -96.95 -6.11 36.32 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.368 -0.832 . . . . 0.0 109.92 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' GLN . . . . . 0.514 ' CG ' HD21 ' B' ' 27' ' ' LEU . 19.5 mm-40 -95.13 -29.01 14.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.33 -0.856 . . . . 0.0 109.659 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.729 HG23 ' O ' ' B' ' 66' ' ' VAL . 33.1 m -130.55 86.69 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.443 -0.786 . . . . 0.0 109.79 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.457 ' HE3' ' NH1' ' B' ' 20' ' ' ARG . 6.9 pttp -43.15 136.18 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.242 -0.911 . . . . 0.0 110.278 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.472 HD12 ' O ' ' B' ' 66' ' ' VAL . 1.4 mp -88.49 148.61 42.58 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.24 -0.912 . . . . 0.0 109.992 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.539 ' HG2' ' CG1' ' B' ' 72' ' ' ILE . 45.0 Cg_endo -71.0 -160.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.1 1.579 . . . . 0.0 110.553 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.554 ' O ' HG23 ' B' ' 71' ' ' THR . 0.4 OUTLIER -104.43 24.77 11.1 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.136 -0.978 . . . . 0.0 110.44 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 71' ' ' THR . . . . . 0.554 HG23 ' O ' ' B' ' 70' ' ' LYS . 2.1 p -154.49 3.67 0.24 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.15 -0.969 . . . . 0.0 111.397 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.765 HD13 ' O ' ' B' ' 8' ' ' LYS . 9.8 mm -95.48 121.49 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.774 -1.204 . . . . 0.0 109.917 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 73' ' ' THR . . . . . 0.46 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 1.6 m -95.28 129.61 42.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.202 -0.936 . . . . 0.0 110.394 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.54 HG13 ' O ' ' B' ' 74' ' ' VAL . 2.6 p -111.65 99.86 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.497 -0.752 . . . . 0.0 109.803 178.57 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.92 174.86 5.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.656 -1.278 . . . . 0.0 110.424 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.1 p -107.8 152.93 23.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.402 -0.811 . . . . 0.0 110.149 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.659 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -161.45 178.49 37.34 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -147.97 139.39 23.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.25 -1.147 . . . . 0.0 110.256 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.0 mtm -126.36 139.14 53.52 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.13 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.89 101.71 6.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.411 ' OXT' HG22 ' B' ' 81' ' ' ILE . 4.1 mt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.07 -0.966 . . . . 0.0 110.207 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.458 ' HB3' ' HB3' ' A' ' 78' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.297 0.57 . . . . 0.0 110.138 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.456 ' O ' HG23 ' A' ' 4' ' ' ILE . 66.8 p -96.23 106.68 30.4 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.384 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.415 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 48.5 Cg_endo -52.82 155.7 10.42 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 O-C-N 124.034 1.544 . . . . 0.0 110.315 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.456 HG23 ' O ' ' A' ' 2' ' ' THR . 7.1 pt -143.47 178.69 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.663 HG13 ' CG1' ' A' ' 74' ' ' VAL . 40.3 t -145.53 136.04 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.281 -0.887 . . . . 0.0 110.381 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.558 ' O ' HG22 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.54 121.4 43.88 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.329 -0.857 . . . . 0.0 109.795 179.647 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.637 HD12 HG12 ' A' ' 5' ' ' VAL . 0.4 OUTLIER -115.51 123.81 49.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.546 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.622 ' HD2' HD11 ' A' ' 48' ' ' ILE . 18.8 tttt -141.48 166.22 25.35 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.236 -0.915 . . . . 0.0 110.209 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.531 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 141.88 -146.07 16.87 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.92 121.38 14.51 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.322 -1.105 . . . . 0.0 110.332 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.18 -35.96 28.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.354 -0.841 . . . . 0.0 110.733 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -75.01 -43.79 51.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.154 -0.966 . . . . 0.0 110.64 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 47.6 m -57.86 -27.01 62.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.206 -0.934 . . . . 0.0 110.507 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.769 ' HA ' HD12 ' A' ' 17' ' ' LEU . 15.7 mt -82.67 -34.45 27.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -59.78 -39.12 83.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 110.117 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.505 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 35.9 t -70.21 -37.84 75.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.407 -0.808 . . . . 0.0 110.571 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.769 HD12 ' HA ' ' A' ' 14' ' ' LEU . 22.7 mt -58.66 -50.56 73.41 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.086 -1.009 . . . . 0.0 110.166 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.408 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 18.1 ttm105 -46.98 -29.15 1.91 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.367 -0.833 . . . . 0.0 110.307 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 72.0 t80 -64.81 -42.12 95.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.234 -0.916 . . . . 0.0 110.503 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 mtt-85 -70.99 -26.24 63.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.926 . . . . 0.0 110.157 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.1 m-30 -66.55 -20.37 66.0 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.217 -0.927 . . . . 0.0 110.398 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -63.29 -27.7 69.51 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.224 -0.923 . . . . 0.0 110.42 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.6 mmtm -75.13 -48.4 23.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.476 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.431 ' CB ' HD12 ' A' ' 27' ' ' LEU . 20.1 m-70 -94.84 52.85 1.53 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.204 -0.935 . . . . 0.0 110.228 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.4 p -57.7 -13.65 4.38 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.154 -0.966 . . . . 0.0 110.742 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.86 13.4 28.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.025 -1.047 . . . . 0.0 110.699 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.618 HD11 ' OE1' ' A' ' 65' ' ' GLN . 3.6 mt -92.06 -45.11 8.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.122 -0.986 . . . . 0.0 110.089 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.769 ' CE2' HG23 ' A' ' 31' ' ' VAL . 28.6 p90 -106.12 172.66 6.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.328 -0.857 . . . . 0.0 109.584 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -100.41 -35.52 9.54 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.864 -1.148 . . . . 0.0 110.99 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 119.84 2.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.091 -1.006 . . . . 0.0 110.81 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.769 HG23 ' CE2' ' A' ' 28' ' ' TYR . 47.1 t -88.42 99.96 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.309 -0.869 . . . . 0.0 110.18 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.775 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -62.12 151.28 36.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 111.663 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.542 ' O ' HG23 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -61.69 159.1 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.441 -0.787 . . . . 0.0 109.761 179.023 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.2 127.6 33.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.773 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 58.6 p-90 -146.39 120.63 9.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.085 -1.009 . . . . 0.0 110.634 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.712 ' CD2' ' HB3' ' A' ' 46' ' ' SER . 29.3 t-80 -78.94 166.44 22.38 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.032 -1.043 . . . . 0.0 109.913 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.569 ' CZ2' HG23 ' B' ' 52' ' ' THR . 0.0 OUTLIER -78.41 50.7 0.96 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.817 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.445 ' C ' ' O ' ' B' ' 31' ' ' VAL . 13.0 t -150.83 165.49 33.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.149 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 40' ' ' HIS . . . -133.15 -170.17 12.37 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.453 ' HB3' ' O ' ' A' ' 39' ' ' GLY . 1.5 t-80 65.6 -131.3 0.24 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.38 -1.071 . . . . 0.0 110.196 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -146.02 96.86 2.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.996 -1.065 . . . . 0.0 110.183 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 2.7 m -107.11 140.01 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.217 -0.927 . . . . 0.0 110.153 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.9 mttt -75.13 -25.19 58.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.234 -0.916 . . . . 0.0 110.215 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -57.12 133.1 54.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.285 -0.884 . . . . 0.0 110.144 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -50.46 150.27 2.73 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.288 -0.882 . . . . 0.0 110.424 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.712 ' HB3' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -167.82 131.09 1.64 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.224 -0.923 . . . . 0.0 110.106 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -164.43 108.23 0.93 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.218 -0.926 . . . . 0.0 110.567 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.622 HD11 ' HD2' ' A' ' 8' ' ' LYS . 80.1 mt -142.27 133.75 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.22 -0.925 . . . . 0.0 110.068 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -125.14 -179.38 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.9 -1.125 . . . . 0.0 110.308 -179.932 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.415 ' N ' HG13 ' A' ' 49' ' ' VAL . 16.8 m -145.06 158.2 43.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.409 -0.807 . . . . 0.0 109.818 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 31' ' ' VAL . 27.0 mt -135.04 131.52 37.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.231 -0.918 . . . . 0.0 110.009 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.463 HG23 ' CZ2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.83 130.56 44.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 110.263 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.415 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 35.0 m-85 -117.8 152.86 34.48 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.387 -0.82 . . . . 0.0 109.986 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -95.48 -18.35 20.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.362 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 77.3 p -145.43 140.44 27.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -61.12 -39.58 90.55 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 0.0 110.226 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.9 t-105 -53.96 -50.45 66.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.286 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.423 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 60.2 tt0 -57.27 -40.1 77.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.424 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -59.32 -38.99 81.7 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.128 -0.983 . . . . 0.0 110.168 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.833 ' HA ' HD12 ' A' ' 63' ' ' LEU . 42.6 m-20 -61.34 -41.42 97.01 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.865 . . . . 0.0 110.53 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.454 ' O ' ' OG ' ' A' ' 64' ' ' SER . 43.5 mt-30 -65.7 -40.08 91.91 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.159 -0.963 . . . . 0.0 110.201 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.775 ' O ' HG22 ' A' ' 66' ' ' VAL . 68.3 t80 -55.76 -42.07 74.92 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.263 -0.898 . . . . 0.0 109.942 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.833 HD12 ' HA ' ' A' ' 60' ' ' ASP . 12.0 mt -59.44 -24.0 63.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.454 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 3.7 p -100.08 -7.89 24.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 110.179 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.618 ' OE1' HD11 ' A' ' 27' ' ' LEU . 0.8 OUTLIER -97.07 -29.31 13.7 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.314 -0.867 . . . . 0.0 109.818 179.746 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.784 ' O ' HG23 ' A' ' 66' ' ' VAL . 19.1 m -110.04 85.36 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.644 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -35.59 104.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.557 -0.715 . . . . 0.0 110.479 -179.517 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 66' ' ' VAL . 82.3 mt -87.67 115.03 61.61 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.176 -0.953 . . . . 0.0 110.467 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -63.4 -158.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 124.073 1.565 . . . . 0.0 110.082 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -106.54 -13.1 15.42 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.108 -0.995 . . . . 0.0 110.328 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.2 p -84.59 -21.97 30.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.639 HD12 HD21 ' A' ' 14' ' ' LEU . 25.1 mm -93.75 108.34 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.285 -0.884 . . . . 0.0 109.858 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.7 m -96.14 153.72 17.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.192 -0.943 . . . . 0.0 110.241 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.663 ' CG1' HG13 ' A' ' 5' ' ' VAL . 6.9 t -145.26 156.17 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.228 -0.92 . . . . 0.0 110.717 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -138.42 -179.07 5.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.51 -0.744 . . . . 0.0 110.061 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' B' ' 80' ' ' SER . 1.6 p -106.31 154.54 20.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.201 -0.937 . . . . 0.0 110.467 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.433 ' C ' HG12 ' A' ' 4' ' ' ILE . . . -161.13 175.3 37.78 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.458 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 79.7 m-85 -147.92 137.88 22.68 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.182 -1.187 . . . . 0.0 110.44 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 7.9 mtt -115.14 162.2 17.37 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.342 -0.849 . . . . 0.0 109.814 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.444 ' O ' HG23 ' A' ' 81' ' ' ILE . 12.4 t -118.66 99.37 6.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.23 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.444 HG23 ' O ' ' A' ' 80' ' ' SER . 1.7 pt . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.248 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.448 ' HB3' ' HB3' ' B' ' 78' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.213 0.53 . . . . 0.0 110.224 . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.457 ' O ' HG23 ' B' ' 4' ' ' ILE . 63.6 p -96.77 106.5 30.72 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.204 -0.935 . . . . 0.0 110.308 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.424 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 48.4 Cg_endo -52.54 155.96 9.3 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.021 1.538 . . . . 0.0 110.302 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.457 HG23 ' O ' ' B' ' 2' ' ' THR . 7.6 pt -143.4 178.48 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.203 -0.936 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.665 HG13 ' CG1' ' B' ' 74' ' ' VAL . 39.8 t -145.64 136.04 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.878 . . . . 0.0 110.257 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.556 ' O ' HG22 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.94 121.1 43.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.365 -0.834 . . . . 0.0 109.783 179.857 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.625 HD12 HG12 ' B' ' 5' ' ' VAL . 0.5 OUTLIER -115.08 124.23 51.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.57 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.601 ' HD2' HD11 ' B' ' 48' ' ' ILE . 18.8 tttt -141.38 166.08 25.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -0.879 . . . . 0.0 110.196 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.53 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 142.04 -146.3 17.21 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.68 121.85 15.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.346 -1.091 . . . . 0.0 110.324 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.71 -35.49 31.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 110.725 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -75.42 -43.59 49.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.175 -0.953 . . . . 0.0 110.561 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 44.4 m -57.86 -28.18 63.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.173 -0.954 . . . . 0.0 110.403 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.76 ' HA ' HD12 ' B' ' 17' ' ' LEU . 13.0 mt -81.9 -34.66 29.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.077 -1.015 . . . . 0.0 110.117 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -59.74 -38.85 82.88 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.326 -0.859 . . . . 0.0 110.171 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.503 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 36.3 t -70.2 -37.71 75.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 0.0 110.485 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.76 HD12 ' HA ' ' B' ' 14' ' ' LEU . 23.0 mt -58.76 -50.61 73.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.142 -0.974 . . . . 0.0 110.107 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -47.16 -28.65 1.91 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.433 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.503 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 72.0 t80 -64.84 -41.92 95.34 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.317 -0.864 . . . . 0.0 110.469 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 26.2 mtt-85 -71.27 -26.42 62.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.0 110.364 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.552 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.5 m-30 -66.64 -20.17 65.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.27 -0.894 . . . . 0.0 110.359 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -63.38 -27.44 69.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.139 -0.976 . . . . 0.0 110.459 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -75.16 -48.32 24.18 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.264 -0.898 . . . . 0.0 110.512 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.423 ' CB ' HD12 ' B' ' 27' ' ' LEU . 18.9 m-70 -94.93 52.88 1.51 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.249 -0.907 . . . . 0.0 110.22 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 p -57.47 -13.72 3.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.29 -0.881 . . . . 0.0 110.558 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.96 13.58 28.42 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.128 -0.982 . . . . 0.0 110.817 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.648 HD11 ' OE1' ' B' ' 65' ' ' GLN . 3.6 mt -92.32 -44.13 8.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.071 -1.018 . . . . 0.0 109.97 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.774 ' CE2' HG23 ' B' ' 31' ' ' VAL . 27.8 p90 -107.14 173.33 6.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.256 -0.903 . . . . 0.0 109.536 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.2 m -100.86 -35.79 9.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.054 -1.029 . . . . 0.0 110.919 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.76 119.86 2.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.165 -0.959 . . . . 0.0 110.684 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.774 HG23 ' CE2' ' B' ' 28' ' ' TYR . 48.5 t -88.19 99.68 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.089 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.773 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -60.78 150.13 33.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 111.485 -179.49 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 33' ' ' SER . . . . . 0.576 ' O ' HG23 ' B' ' 49' ' ' VAL . 0.3 OUTLIER -61.7 159.65 13.1 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.551 -0.718 . . . . 0.0 109.575 179.107 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.405 ' HA ' HG23 ' B' ' 49' ' ' VAL . 0.5 OUTLIER -68.25 127.41 32.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.036 -1.04 . . . . 0.0 110.616 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.775 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 58.4 p-90 -146.22 120.73 9.72 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.024 -1.047 . . . . 0.0 110.701 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.72 ' CD2' ' HB3' ' B' ' 46' ' ' SER . 29.8 t-80 -78.86 166.48 22.38 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.933 -1.104 . . . . 0.0 109.902 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.579 ' HA ' ' CE3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -78.57 50.93 1.01 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.102 -0.998 . . . . 0.0 110.129 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 31' ' ' VAL . 13.6 t -150.71 169.95 20.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.32 -0.863 . . . . 0.0 110.184 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 39' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' B' ' 40' ' ' HIS . . . -137.09 -171.32 12.15 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 40' ' ' HIS . . . . . 0.465 ' HB3' ' O ' ' B' ' 39' ' ' GLY . 1.5 t-80 66.0 -131.79 0.21 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.285 -1.127 . . . . 0.0 110.18 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -145.11 97.44 3.01 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.981 -1.074 . . . . 0.0 110.293 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.7 m -107.71 140.64 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.278 -0.889 . . . . 0.0 109.912 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -75.74 -25.33 56.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.184 -0.947 . . . . 0.0 110.184 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -56.48 132.59 51.77 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.207 -0.933 . . . . 0.0 110.228 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -50.22 150.33 2.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.293 -0.88 . . . . 0.0 110.297 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.72 ' HB3' ' CD2' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -167.62 132.88 1.94 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.335 -0.853 . . . . 0.0 110.095 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -166.38 108.61 0.72 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.164 -0.96 . . . . 0.0 110.583 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.601 HD11 ' HD2' ' B' ' 8' ' ' LYS . 85.3 mt -142.38 134.23 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.326 -0.859 . . . . 0.0 109.799 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 49' ' ' VAL . . . . . 0.576 HG23 ' O ' ' B' ' 33' ' ' SER . 0.3 OUTLIER -125.91 -179.4 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.841 -1.162 . . . . 0.0 110.306 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.401 ' N ' HG13 ' B' ' 49' ' ' VAL . 17.1 m -145.03 158.43 43.82 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.318 -0.863 . . . . 0.0 109.97 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' B' ' 31' ' ' VAL . 25.2 mt -134.97 131.44 37.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.23 -0.919 . . . . 0.0 109.982 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.569 HG23 ' CZ2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.62 130.77 43.76 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.313 -0.867 . . . . 0.0 110.167 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.424 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 35.5 m-85 -118.07 153.3 33.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.346 -0.846 . . . . 0.0 110.003 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -95.4 -18.49 20.69 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.25 -0.906 . . . . 0.0 110.397 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 p -145.32 140.33 27.66 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.152 -0.967 . . . . 0.0 110.307 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.1 -39.3 89.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.288 -0.883 . . . . 0.0 110.044 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -54.12 -50.99 65.64 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.232 -0.917 . . . . 0.0 110.237 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.425 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 60.9 tt0 -57.08 -39.7 75.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.409 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -59.69 -38.86 82.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.085 -1.009 . . . . 0.0 110.006 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.859 ' HA ' HD12 ' B' ' 63' ' ' LEU . 43.4 m-20 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.416 -0.803 . . . . 0.0 110.441 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.448 ' O ' ' OG ' ' B' ' 64' ' ' SER . 44.1 mt-30 -65.83 -40.0 91.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.252 -0.905 . . . . 0.0 110.283 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.798 ' O ' HG22 ' B' ' 66' ' ' VAL . 69.5 t80 -55.83 -41.68 74.6 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 109.754 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.859 HD12 ' HA ' ' B' ' 60' ' ' ASP . 13.0 mt -59.51 -24.58 63.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.336 -0.852 . . . . 0.0 110.049 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.448 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 3.9 p -99.87 -7.9 24.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.299 -0.876 . . . . 0.0 110.144 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 65' ' ' GLN . . . . . 0.648 ' OE1' HD11 ' B' ' 27' ' ' LEU . 0.9 OUTLIER -97.08 -29.13 13.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.303 -0.873 . . . . 0.0 109.881 179.739 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.798 HG22 ' O ' ' B' ' 62' ' ' PHE . 20.3 m -110.0 83.58 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.323 -0.861 . . . . 0.0 109.912 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.55 ' O ' ' CG ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -33.47 104.14 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.497 -0.752 . . . . 0.0 110.627 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.508 HG13 ' O ' ' B' ' 66' ' ' VAL . 84.8 mt -87.89 114.49 59.38 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 110.534 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.75 -159.03 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.845 0 O-C-N 124.211 1.637 . . . . 0.0 110.236 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -106.24 -12.84 15.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.184 -0.948 . . . . 0.0 110.492 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 29.9 p -84.69 -21.97 29.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.161 -0.962 . . . . 0.0 110.13 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.641 HD12 HD21 ' B' ' 14' ' ' LEU . 24.8 mm -94.12 108.5 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.287 -0.883 . . . . 0.0 109.751 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -96.09 153.64 17.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.109 -0.995 . . . . 0.0 110.07 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.665 ' CG1' HG13 ' B' ' 5' ' ' VAL . 6.0 t -144.99 155.98 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.107 -0.995 . . . . 0.0 110.546 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 3.3 t -138.6 -178.92 5.52 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.154 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -106.15 154.04 21.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.306 -0.871 . . . . 0.0 110.592 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.448 ' C ' HG12 ' B' ' 4' ' ' ILE . . . -160.75 174.91 37.47 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.448 ' HB3' ' HB3' ' B' ' 1' ' ' MET . 80.1 m-85 -147.99 138.07 22.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.212 -1.169 . . . . 0.0 110.416 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 7.7 mtt -115.3 161.69 18.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.208 -0.933 . . . . 0.0 109.935 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.467 ' HB3' ' O ' ' A' ' 76' ' ' THR . 13.1 t -118.37 98.95 6.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.184 -0.948 . . . . 0.0 110.168 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.445 HG23 ' O ' ' B' ' 80' ' ' SER . 1.6 pt . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.069 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 mtp . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.253 0.549 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.658 ' O ' HG23 ' A' ' 2' ' ' THR . 5.5 t -100.95 103.83 27.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.274 -0.891 . . . . 0.0 110.419 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 48.8 Cg_endo -49.33 157.94 1.83 Allowed 'Trans proline' 0 C--N 1.305 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.238 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.698 ' O ' HD12 ' A' ' 4' ' ' ILE . 2.3 pp -143.91 119.02 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.131 -0.981 . . . . 0.0 110.488 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.455 HG13 ' CG2' ' A' ' 74' ' ' VAL . 1.2 t -94.08 136.57 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.226 -0.921 . . . . 0.0 110.257 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.47 138.62 41.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.301 -0.874 . . . . 0.0 109.695 179.529 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.584 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.3 OUTLIER -129.57 131.13 46.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.958 -1.089 . . . . 0.0 110.569 -179.55 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 14.4 ttpp -141.52 167.02 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.29 -0.881 . . . . 0.0 109.951 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.474 ' O ' ' HB3' ' A' ' 46' ' ' SER . . . 145.6 -151.06 23.31 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.781 -1.327 . . . . 0.0 109.781 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 13' ' ' THR . 8.3 m-20 -65.33 127.22 30.88 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.317 -1.108 . . . . 0.0 110.715 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.62 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.32 -68.81 0.14 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 0.0 110.398 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -46.0 -43.61 14.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 110.177 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.485 HG22 HD11 ' A' ' 72' ' ' ILE . 22.3 m -57.94 -18.25 22.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 110.104 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.947 ' HA ' HD12 ' A' ' 17' ' ' LEU . 19.7 mt -91.53 -29.88 16.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.306 -0.871 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.0 mmtt -59.03 -41.43 87.77 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.204 -0.935 . . . . 0.0 110.481 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 t -69.74 -36.49 75.89 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.381 -0.824 . . . . 0.0 110.547 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.947 HD12 ' HA ' ' A' ' 14' ' ' LEU . 46.0 mt -58.92 -54.49 46.55 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.04 -1.038 . . . . 0.0 110.36 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -45.81 -32.1 2.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.307 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.82 -29.34 70.29 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.215 -0.928 . . . . 0.0 110.213 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -69.87 -21.8 63.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.025 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.708 ' CE2' HD21 ' A' ' 51' ' ' LEU . 10.2 m-30 -66.47 -36.41 82.68 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 110.045 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -63.61 -33.79 76.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.429 -0.795 . . . . 0.0 110.218 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -74.96 -9.43 58.53 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.207 -0.933 . . . . 0.0 109.863 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.551 ' HB3' HD12 ' A' ' 27' ' ' LEU . 99.1 m-70 -145.04 43.53 1.33 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.831 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.485 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.8 t -57.74 -8.58 0.95 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.421 -0.8 . . . . 0.0 111.039 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.6 p -95.78 7.69 45.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.93 -1.106 . . . . 0.0 110.292 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.551 HD12 ' HB3' ' A' ' 24' ' ' HIS . 5.0 mt -92.33 -54.87 3.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 0.0 109.864 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.639 ' CD1' HG13 ' A' ' 31' ' ' VAL . 31.7 p90 -93.65 169.84 10.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.1 m -100.61 -33.24 10.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.081 -1.012 . . . . 0.0 110.811 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.49 114.7 2.44 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.959 -1.088 . . . . 0.0 110.748 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.68 HG12 ' CD2' ' A' ' 51' ' ' LEU . 20.5 m -90.57 112.9 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 110.187 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.568 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -68.45 147.94 51.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.157 -0.964 . . . . 0.0 110.342 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -61.5 159.64 12.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.895 ' HA ' HG23 ' A' ' 49' ' ' VAL . 91.7 m -68.18 134.86 51.16 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.356 -0.84 . . . . 0.0 110.447 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.59 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 60.2 p-90 -146.66 -178.39 6.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 0.0 109.564 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.576 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 70.6 t60 -162.43 174.23 13.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.893 -1.129 . . . . 0.0 110.66 -179.392 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 74.7 m95 -78.65 103.41 8.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.274 -0.891 . . . . 0.0 110.281 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.448 ' O ' HG23 ' B' ' 31' ' ' VAL . 3.0 p -117.79 -179.49 3.76 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.349 -0.844 . . . . 0.0 110.217 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -174.2 -89.35 0.07 OUTLIER Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -138.66 -62.9 0.55 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.432 -1.04 . . . . 0.0 110.127 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -102.49 99.97 10.04 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.268 -0.895 . . . . 0.0 110.185 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.0 m -136.15 144.63 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.268 -0.895 . . . . 0.0 110.187 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.6 mtpt -94.14 -91.66 0.19 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 110.292 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.541 ' CG ' ' O ' ' A' ' 44' ' ' HIS . 31.0 p-80 -149.36 120.27 7.64 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.189 -0.945 . . . . 0.0 110.132 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HB2' ' CE1' ' A' ' 36' ' ' HIS . 69.8 mmtt -118.73 -123.38 0.29 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.217 -0.927 . . . . 0.0 110.344 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.474 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 0.1 OUTLIER -146.18 108.13 4.36 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.027 -1.046 . . . . 0.0 110.573 -179.747 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . -39.16 157.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.492 -0.755 . . . . 0.0 110.567 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.584 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.9 mt -143.85 148.48 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.41 -0.806 . . . . 0.0 109.939 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.895 HG23 ' HA ' ' A' ' 34' ' ' THR . 0.4 OUTLIER -128.16 -179.48 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.1 -1.0 . . . . 0.0 110.276 -179.899 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.566 ' N ' HG13 ' A' ' 49' ' ' VAL . 96.4 m -145.98 154.05 41.47 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.256 -0.903 . . . . 0.0 110.009 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.708 HD21 ' CE2' ' A' ' 21' ' ' PHE . 17.7 mt -132.91 124.09 27.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.148 -0.97 . . . . 0.0 110.24 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 132.88 42.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.28 -0.887 . . . . 0.0 110.263 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 45.0 m-85 -117.73 153.87 32.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -0.876 . . . . 0.0 110.188 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -85.25 -9.99 57.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 110.574 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -162.46 160.43 26.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.135 -0.978 . . . . 0.0 110.238 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -70.99 -37.85 72.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.18 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -53.97 -52.38 60.87 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 21.5 tt0 -58.08 -36.03 72.26 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.335 -0.853 . . . . 0.0 110.624 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp85 -59.13 -54.13 50.46 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.101 -0.999 . . . . 0.0 110.601 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.551 ' HA ' HD12 ' A' ' 63' ' ' LEU . 2.2 t70 -61.05 -26.34 67.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.201 -0.937 . . . . 0.0 110.364 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 46.7 mt-30 -65.54 -54.89 21.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 109.785 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 1.067 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.8 t80 -55.63 -39.74 71.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.905 . . . . 0.0 109.832 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 60' ' ' ASP . 9.2 mt -59.19 -23.64 62.42 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 110.068 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.71 -18.69 21.06 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.31 -0.869 . . . . 0.0 110.149 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -93.93 -9.05 38.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.178 -0.951 . . . . 0.0 109.89 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 1.067 HG22 ' O ' ' A' ' 62' ' ' PHE . 34.0 m -136.41 133.09 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.367 -0.833 . . . . 0.0 109.811 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 103.08 11.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.241 -0.912 . . . . 0.0 109.785 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.722 ' CG2' HD12 ' A' ' 72' ' ' ILE . 18.1 mt -88.08 130.94 44.4 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.437 -0.789 . . . . 0.0 110.336 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.55 ' HD2' ' CG2' ' A' ' 68' ' ' ILE . 41.6 Cg_endo -40.53 162.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.639 0 O-C-N 123.969 1.51 . . . . 0.0 110.463 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -74.99 3.35 8.5 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.298 -0.876 . . . . 0.0 110.882 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -24.87 28.79 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.043 -1.035 . . . . 0.0 109.842 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.722 HD12 ' CG2' ' A' ' 68' ' ' ILE . 81.2 mt -95.41 109.11 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.51 -0.743 . . . . 0.0 110.503 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 79.4 m -96.14 157.0 16.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.219 -0.926 . . . . 0.0 110.451 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 6' ' ' HIS . 3.4 p -143.07 136.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.106 -0.996 . . . . 0.0 111.409 -179.086 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.23 -179.53 4.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.294 0.568 . . . . 0.0 110.141 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 50.2 p -128.94 154.33 46.66 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.306 -0.871 . . . . 0.0 109.96 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -171.54 -170.33 35.46 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.414 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 56.2 m-85 -147.53 150.63 34.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.355 -1.085 . . . . 0.0 110.32 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 1.1 ttt -124.61 167.61 14.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.235 -0.915 . . . . 0.0 109.989 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 27.4 t -131.47 103.68 6.56 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.0 110.309 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.603 ' O ' HG23 ' A' ' 81' ' ' ILE . 6.5 tt . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.257 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 mtp . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.247 0.546 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.652 ' O ' HG23 ' B' ' 2' ' ' THR . 5.4 t -101.31 104.46 33.47 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 110.401 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.525 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -50.16 157.63 2.86 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 123.974 1.513 . . . . 0.0 110.114 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.683 ' O ' HD12 ' B' ' 4' ' ' ILE . 2.3 pp -143.87 119.05 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.217 -0.927 . . . . 0.0 110.325 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.437 HG13 ' CG2' ' B' ' 74' ' ' VAL . 1.1 t -94.11 136.11 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.262 -0.899 . . . . 0.0 110.301 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.503 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.2 138.57 41.19 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.29 -0.881 . . . . 0.0 109.666 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.608 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.3 OUTLIER -129.77 131.4 46.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.004 -1.06 . . . . 0.0 110.607 -179.484 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 15.0 ttpp -141.43 167.17 22.8 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.983 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.473 ' O ' ' HB3' ' B' ' 46' ' ' SER . . . 145.66 -151.53 23.72 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 10' ' ' ASP . . . . . 0.411 ' O ' ' HB ' ' B' ' 13' ' ' THR . 9.6 m-20 -64.93 127.25 30.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.275 -1.132 . . . . 0.0 110.655 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.635 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.34 -68.99 0.13 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.275 -0.89 . . . . 0.0 110.282 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 12' ' ' ASN . . . . . 0.411 ' OD1' ' N ' ' B' ' 13' ' ' THR . 10.3 p30 -45.71 -43.93 13.2 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.496 HG22 HD11 ' B' ' 72' ' ' ILE . 22.2 m -57.83 -18.02 19.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.289 -0.882 . . . . 0.0 110.096 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.946 ' HA ' HD12 ' B' ' 17' ' ' LEU . 18.6 mt -91.74 -29.63 16.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.254 -0.904 . . . . 0.0 110.337 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.5 mmtt -59.17 -41.17 87.8 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.331 -0.856 . . . . 0.0 110.519 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 15.8 t -69.96 -36.56 75.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.368 -0.832 . . . . 0.0 110.564 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.946 HD12 ' HA ' ' B' ' 14' ' ' LEU . 44.4 mt -59.04 -54.12 50.68 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.115 -0.991 . . . . 0.0 110.495 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -46.08 -31.99 2.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.838 . . . . 0.0 110.332 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.89 -29.85 70.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.161 -0.962 . . . . 0.0 110.081 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -69.6 -21.95 63.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.262 -0.899 . . . . 0.0 110.008 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.7 ' CE2' HD21 ' B' ' 51' ' ' LEU . 10.2 m-30 -66.48 -36.3 82.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.87 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -63.71 -34.0 76.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.377 -0.827 . . . . 0.0 110.222 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -74.88 -9.3 58.41 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.161 -0.962 . . . . 0.0 109.753 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.535 ' HB3' HD12 ' B' ' 27' ' ' LEU . 99.0 m-70 -145.16 43.66 1.32 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.379 -0.826 . . . . 0.0 109.948 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.467 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.8 t -57.73 -8.9 1.02 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.341 -0.849 . . . . 0.0 111.136 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 68.9 p -95.38 7.62 45.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.959 -1.088 . . . . 0.0 110.327 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.535 HD12 ' HB3' ' B' ' 24' ' ' HIS . 5.0 mt -92.41 -54.49 3.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.878 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.65 ' CD1' HG13 ' B' ' 31' ' ' VAL . 31.6 p90 -93.7 169.46 10.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.273 -0.892 . . . . 0.0 109.779 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 5.5 m -100.53 -33.15 10.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.116 -0.99 . . . . 0.0 110.815 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.44 114.55 2.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.1 -1.0 . . . . 0.0 110.843 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.688 HG12 ' CD2' ' B' ' 51' ' ' LEU . 17.0 m -90.6 111.63 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.405 -0.809 . . . . 0.0 110.119 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.59 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -67.6 148.33 51.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.11 -0.994 . . . . 0.0 110.502 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 33' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -61.6 158.96 14.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.344 -0.847 . . . . 0.0 110.245 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.883 ' HA ' HG23 ' B' ' 49' ' ' VAL . 86.1 m -68.18 134.9 51.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.317 -0.864 . . . . 0.0 110.602 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.568 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 59.5 p-90 -146.75 -178.17 6.04 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 109.549 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.583 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 70.4 t60 -162.35 174.44 12.79 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.828 -1.17 . . . . 0.0 110.685 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.583 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 73.5 m95 -78.54 103.57 8.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.183 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 31' ' ' VAL . 3.0 p -118.28 -179.81 3.89 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.268 -0.895 . . . . 0.0 110.167 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -173.95 -89.67 0.08 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -138.17 -62.82 0.57 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.334 -1.098 . . . . 0.0 110.163 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 36.5 m120 -102.56 99.55 9.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.216 -0.928 . . . . 0.0 110.154 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 28.3 m -135.59 143.85 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.259 -0.901 . . . . 0.0 110.128 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -93.36 -92.51 0.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.364 -0.835 . . . . 0.0 110.078 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' HIS . . . . . 0.518 ' CG ' ' O ' ' B' ' 44' ' ' HIS . 31.9 p-80 -148.28 122.03 9.28 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.087 -1.008 . . . . 0.0 110.111 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -120.09 -122.37 0.29 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.227 -0.921 . . . . 0.0 110.429 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.473 ' HB3' ' O ' ' B' ' 9' ' ' GLY . 0.1 OUTLIER -147.02 107.64 4.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.993 -1.067 . . . . 0.0 110.641 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.519 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . . . -39.0 157.31 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.415 -0.803 . . . . 0.0 110.44 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.608 HG23 ' O ' ' B' ' 7' ' ' LEU . 44.5 mt -143.93 148.22 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 0.0 110.024 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 49' ' ' VAL . . . . . 0.883 HG23 ' HA ' ' B' ' 34' ' ' THR . 0.4 OUTLIER -127.47 -179.33 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.134 -0.979 . . . . 0.0 110.193 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.585 ' N ' HG13 ' B' ' 49' ' ' VAL . 93.4 m -145.73 154.27 41.87 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.7 HD21 ' CE2' ' B' ' 21' ' ' PHE . 18.9 mt -133.14 123.53 25.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.052 -1.03 . . . . 0.0 110.207 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.12 133.69 41.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 110.201 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.525 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 44.2 m-85 -118.91 154.41 33.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.275 -0.891 . . . . 0.0 110.226 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.09 -10.66 56.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 0.0 110.522 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -162.16 160.71 27.51 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.08 -1.012 . . . . 0.0 110.434 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 78.5 mt-10 -70.72 -38.81 73.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.238 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -53.63 -52.18 60.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 110.229 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.482 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 21.9 tt0 -58.25 -35.93 72.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.602 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 13.2 ttp85 -59.19 -54.33 48.21 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.054 -1.028 . . . . 0.0 110.68 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.538 ' HA ' HD12 ' B' ' 63' ' ' LEU . 2.5 t70 -61.0 -26.1 67.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 110.295 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 45.3 mt-30 -65.54 -54.89 21.64 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.22 -0.925 . . . . 0.0 109.915 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 1.046 ' O ' HG22 ' B' ' 66' ' ' VAL . 1.7 t80 -55.67 -39.95 71.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.833 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' B' ' 60' ' ' ASP . 9.0 mt -59.19 -23.61 62.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.3 -0.875 . . . . 0.0 110.044 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.22 -18.95 21.18 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.217 -0.927 . . . . 0.0 110.362 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -94.43 -8.34 38.88 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.209 -0.932 . . . . 0.0 110.042 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 1.046 HG22 ' O ' ' B' ' 62' ' ' PHE . 33.6 m -136.7 132.79 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.362 -0.836 . . . . 0.0 109.676 179.512 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 103.05 11.19 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.346 -0.846 . . . . 0.0 109.793 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.679 ' CG2' HD12 ' B' ' 72' ' ' ILE . 18.2 mt -87.98 130.67 45.61 Favored Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.297 -0.877 . . . . 0.0 110.215 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.55 ' HD2' ' CG2' ' B' ' 68' ' ' ILE . 40.7 Cg_endo -40.56 163.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 O-C-N 123.889 1.468 . . . . 0.0 110.501 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -75.47 3.03 10.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.334 -0.854 . . . . 0.0 111.008 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.56 -24.83 29.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.052 -1.03 . . . . 0.0 109.902 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.679 HD12 ' CG2' ' B' ' 68' ' ' ILE . 84.4 mt -95.55 108.6 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 110.417 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 89.9 m -95.83 157.31 15.95 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.41 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 6' ' ' HIS . 3.2 p -143.29 137.37 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 111.539 -179.003 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.22 -179.4 3.94 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.343 0.592 . . . . 0.0 110.167 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 46.5 p -128.83 154.37 46.51 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 109.929 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.419 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -171.72 -170.16 35.39 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.419 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 57.7 m-85 -147.58 151.25 35.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.33 -1.1 . . . . 0.0 110.284 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -125.16 167.14 15.23 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 0.0 109.982 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 27.3 t -131.06 103.95 6.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.097 -1.002 . . . . 0.0 110.284 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.619 HG23 ' O ' ' B' ' 81' ' ' ILE . 6.7 tt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.232 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mtp . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.72 ' O ' HG23 ' A' ' 2' ' ' THR . 15.1 t -92.0 113.78 60.04 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.978 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.502 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -62.55 160.33 32.54 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.894 1.47 . . . . 0.0 110.281 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.436 HG21 ' SD ' ' A' ' 79' ' ' MET . 1.0 OUTLIER -143.29 122.37 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.372 -0.83 . . . . 0.0 109.939 179.736 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.72 HG13 ' CG2' ' A' ' 74' ' ' VAL . 85.5 t -94.28 130.08 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.2 -0.937 . . . . 0.0 110.616 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.546 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.83 122.22 45.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.245 -0.909 . . . . 0.0 109.729 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.533 ' HG ' ' CG2' ' A' ' 72' ' ' ILE . 0.7 OUTLIER -115.67 135.97 53.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 0.0 110.792 -179.35 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.492 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 4.3 ttpp -140.65 166.18 25.44 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.216 -0.928 . . . . 0.0 109.834 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.466 ' O ' ' HB2' ' A' ' 46' ' ' SER . . . 150.9 -156.14 26.52 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -64.97 130.66 44.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.344 -1.092 . . . . 0.0 110.666 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.54 -63.1 1.23 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.301 -0.874 . . . . 0.0 110.551 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -44.87 -47.29 11.14 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 0.0 110.58 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.449 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 97.0 m -57.77 -30.52 65.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.16 -0.963 . . . . 0.0 110.545 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.968 ' HA ' HD12 ' A' ' 17' ' ' LEU . 6.8 mt -70.59 -33.51 71.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.17 -0.956 . . . . 0.0 110.263 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.51 -44.14 93.22 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.237 -0.914 . . . . 0.0 110.753 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 21.5 t -69.82 -38.24 76.51 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.246 -0.909 . . . . 0.0 110.856 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.968 HD12 ' HA ' ' A' ' 14' ' ' LEU . 21.6 mt -58.81 -56.19 25.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.561 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -45.95 -28.22 1.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.0 110.29 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.461 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 61.0 t80 -64.82 -31.12 72.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.176 -0.953 . . . . 0.0 109.903 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -67.61 -21.77 65.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.317 -0.864 . . . . 0.0 110.07 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.493 ' CE2' HD21 ' A' ' 51' ' ' LEU . 10.2 m-30 -66.25 -36.43 82.99 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.026 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -63.52 -41.0 98.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.277 -0.889 . . . . 0.0 110.031 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.06 -2.09 25.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.188 -0.945 . . . . 0.0 109.847 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.487 ' HB3' HD12 ' A' ' 27' ' ' LEU . 84.8 m-70 -144.69 35.48 1.16 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.412 -0.805 . . . . 0.0 109.351 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.524 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.6 t -57.55 -9.41 1.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.576 -0.702 . . . . 0.0 111.054 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.4 p -95.51 4.9 52.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.986 -1.071 . . . . 0.0 110.411 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.507 ' HA ' HD23 ' A' ' 27' ' ' LEU . 8.8 mt -92.59 -48.78 6.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.161 -0.962 . . . . 0.0 110.171 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.524 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 10.2 p90 -100.67 165.78 11.22 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.974 . . . . 0.0 109.755 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 m -101.33 -30.32 11.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.93 -1.106 . . . . 0.0 110.887 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.3 111.38 2.13 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.048 -1.033 . . . . 0.0 110.899 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.47 HG12 HD23 ' A' ' 51' ' ' LEU . 31.9 m -90.58 140.63 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.27 -0.894 . . . . 0.0 110.02 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.6 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.0 OUTLIER -90.89 145.56 24.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 162.12 8.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.247 -0.908 . . . . 0.0 110.43 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.5 m -68.32 132.5 47.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.276 -0.89 . . . . 0.0 110.475 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.622 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 55.5 p-90 -146.81 -178.33 6.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 109.826 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.638 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 25.6 t60 -162.35 174.43 12.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.001 -1.062 . . . . 0.0 110.719 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.638 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 34.4 m95 -78.57 98.28 6.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.519 -0.738 . . . . 0.0 110.024 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.8 p -114.52 -178.46 3.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 110.225 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -177.28 -103.87 0.17 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.261 -1.536 . . . . 0.0 109.261 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -117.22 -64.8 1.26 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.299 -1.118 . . . . 0.0 110.213 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 80.0 m-20 -98.82 98.72 9.78 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.208 -0.933 . . . . 0.0 110.119 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 42' ' ' VAL . 9.2 m -133.46 116.1 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.156 -0.965 . . . . 0.0 110.424 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -69.94 -80.14 0.05 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.234 -0.916 . . . . 0.0 109.93 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.575 ' CG ' ' O ' ' A' ' 44' ' ' HIS . 40.5 p-80 -165.4 119.7 1.25 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.363 -0.836 . . . . 0.0 109.929 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.616 ' HB2' ' CE1' ' A' ' 36' ' ' HIS . 15.4 mmtt -114.55 -133.37 0.34 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.281 -0.887 . . . . 0.0 110.352 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.466 ' HB2' ' O ' ' A' ' 9' ' ' GLY . 77.9 p -131.04 106.98 8.74 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.175 -0.953 . . . . 0.0 110.62 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.506 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . -40.02 157.11 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.387 -0.82 . . . . 0.0 110.415 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.502 HG13 ' C ' ' A' ' 47' ' ' ALA . 19.6 mt -143.95 167.81 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 110.032 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 50' ' ' THR . 0.3 OUTLIER -147.16 -179.75 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.055 -1.028 . . . . 0.0 110.294 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.434 ' O ' ' OG ' ' A' ' 32' ' ' SER . 87.5 m -146.55 156.66 43.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.88 . . . . 0.0 109.945 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.493 HD21 ' CE2' ' A' ' 21' ' ' PHE . 1.5 mt -134.77 125.19 26.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.071 -1.018 . . . . 0.0 110.061 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 134.58 40.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.29 -0.882 . . . . 0.0 110.456 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.502 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 47.1 m-85 -120.25 154.83 34.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.232 -0.917 . . . . 0.0 110.308 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -86.4 -10.06 55.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 110.572 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.72 150.53 17.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.135 -0.978 . . . . 0.0 110.404 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 24.7 mt-10 -64.08 -39.08 93.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.898 . . . . 0.0 109.992 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.433 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 61.8 t-105 -53.57 -52.13 60.72 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.301 -0.874 . . . . 0.0 109.881 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.441 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 13.8 tt0 -57.37 -35.45 69.98 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.383 -0.823 . . . . 0.0 110.483 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 21.5 ttp85 -59.63 -50.45 73.81 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.083 -1.011 . . . . 0.0 110.966 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -60.93 -33.09 72.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.177 -0.952 . . . . 0.0 110.796 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.433 ' HG3' ' O ' ' A' ' 57' ' ' TRP . 35.1 mt-30 -65.62 -47.34 75.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.158 -0.964 . . . . 0.0 110.207 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.989 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.0 OUTLIER -55.69 -44.0 76.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 110.033 179.714 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.6 mt -59.22 -35.62 73.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.282 -0.886 . . . . 0.0 110.491 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.7 t -77.72 -18.9 56.07 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.147 -0.971 . . . . 0.0 110.449 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -94.63 -9.44 35.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.621 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.989 HG22 ' O ' ' A' ' 62' ' ' PHE . 27.5 m -141.91 92.92 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.042 -1.036 . . . . 0.0 110.545 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -76.18 113.16 13.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.17 -0.956 . . . . 0.0 109.933 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.862 HG22 ' HD2' ' A' ' 69' ' ' PRO . 0.0 OUTLIER -89.76 162.94 34.5 Favored Pre-proline 0 N--CA 1.498 1.939 0 O-C-N 121.096 -1.003 . . . . 0.0 109.765 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.862 ' HD2' HG22 ' A' ' 68' ' ' ILE . 46.7 Cg_endo -60.93 -178.9 0.25 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.893 1.47 . . . . 0.0 110.133 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -91.97 -6.15 51.79 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 110.44 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.0 m -84.58 -20.35 31.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.0 110.022 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.533 ' CG2' ' HG ' ' A' ' 7' ' ' LEU . 33.0 mt -94.38 107.18 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.276 -0.89 . . . . 0.0 110.204 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -95.44 157.38 15.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 111.055 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.72 ' CG2' HG13 ' A' ' 5' ' ' VAL . 8.8 p -142.2 130.66 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.938 0.875 . . . . 0.0 111.24 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.75 172.79 6.64 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.311 0.577 . . . . 0.0 110.474 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.9 p -111.54 144.33 40.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.393 -0.817 . . . . 0.0 109.975 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -154.61 176.22 32.45 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -147.72 146.75 29.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.316 -1.108 . . . . 0.0 110.139 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.436 ' SD ' HG21 ' A' ' 4' ' ' ILE . 25.2 mtt -120.22 176.97 5.19 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.097 -1.002 . . . . 0.0 110.324 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.9 t -139.67 107.33 5.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.315 -0.866 . . . . 0.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.309 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mtp . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.217 0.532 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.716 ' O ' HG23 ' B' ' 2' ' ' THR . 15.2 t -92.21 113.82 60.35 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.23 -0.919 . . . . 0.0 109.94 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -62.4 160.15 32.72 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 123.999 1.526 . . . . 0.0 110.333 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.471 HG21 ' SD ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -143.31 122.02 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.251 -0.906 . . . . 0.0 109.896 179.768 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.732 HG13 ' CG2' ' B' ' 74' ' ' VAL . 85.0 t -94.13 130.02 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.676 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.537 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.5 122.97 47.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.279 -0.888 . . . . 0.0 109.565 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.547 ' HG ' ' CG2' ' B' ' 72' ' ' ILE . 0.7 OUTLIER -116.28 135.65 53.7 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.174 -0.954 . . . . 0.0 110.777 -179.427 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.499 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 4.4 ttpp -140.66 165.42 27.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 109.959 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' B' ' 46' ' ' SER . . . 151.58 -155.78 26.33 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -65.0 130.96 45.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -1.117 . . . . 0.0 110.644 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.507 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.75 -62.66 1.47 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.393 -0.817 . . . . 0.0 110.613 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -45.64 -46.61 14.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 0.0 110.673 -179.603 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.423 HG22 HD11 ' B' ' 17' ' ' LEU . 97.1 m -58.09 -30.6 66.37 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.226 -0.921 . . . . 0.0 110.493 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.952 ' HA ' HD12 ' B' ' 17' ' ' LEU . 6.8 mt -70.83 -32.93 70.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 110.259 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.34 -44.44 92.64 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.295 -0.878 . . . . 0.0 110.651 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.456 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 16.4 t -70.14 -38.11 75.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.28 -0.888 . . . . 0.0 111.151 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.952 HD12 ' HA ' ' B' ' 14' ' ' LEU . 21.6 mt -58.65 -55.66 32.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.067 -1.02 . . . . 0.0 110.334 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -45.96 -29.05 1.29 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.264 -0.897 . . . . 0.0 110.251 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.456 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 60.0 t80 -64.76 -29.5 70.48 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.968 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -68.95 -21.58 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.32 -0.863 . . . . 0.0 110.015 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.509 ' CE2' HD21 ' B' ' 51' ' ' LEU . 9.5 m-30 -66.41 -36.94 84.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.897 . . . . 0.0 110.051 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -63.38 -40.83 98.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -75.05 -1.78 24.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.189 -0.944 . . . . 0.0 109.659 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.46 ' HB3' HD12 ' B' ' 27' ' ' LEU . 84.0 m-70 -144.86 35.19 1.13 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.443 -0.786 . . . . 0.0 109.421 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.526 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.7 t -57.61 -8.7 0.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.437 -0.789 . . . . 0.0 111.045 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 66.7 p -95.78 4.54 52.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.011 -1.056 . . . . 0.0 110.392 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' B' ' 27' ' ' LEU . 8.7 mt -92.32 -49.81 5.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 0.0 110.053 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.526 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 10.4 p90 -99.45 165.71 11.52 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 8.7 m -101.46 -30.96 11.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.037 -1.04 . . . . 0.0 110.969 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.37 111.63 2.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.072 -1.018 . . . . 0.0 110.71 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.505 HG12 HD23 ' B' ' 51' ' ' LEU . 32.9 m -90.59 143.35 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 110.127 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.622 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -92.09 144.99 24.87 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.15 -0.969 . . . . 0.0 110.459 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 161.7 9.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.381 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 15.7 m -68.09 132.14 46.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.279 -0.888 . . . . 0.0 110.508 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.6 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 56.1 p-90 -146.76 -177.97 5.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.876 . . . . 0.0 109.774 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.637 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 25.0 t60 -162.38 174.48 12.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.951 -1.093 . . . . 0.0 110.548 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.637 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 39.3 m95 -78.37 100.06 6.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.402 -0.811 . . . . 0.0 109.763 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 24.5 p -116.18 179.44 3.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.815 . . . . 0.0 110.314 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -175.7 -103.44 0.17 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.409 -1.477 . . . . 0.0 109.409 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -117.5 -65.49 1.18 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.276 -1.132 . . . . 0.0 110.194 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 81.8 m-20 -98.08 99.46 10.73 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.191 -0.943 . . . . 0.0 110.101 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.443 ' O ' HG23 ' B' ' 42' ' ' VAL . 11.2 m -134.43 114.96 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.17 -0.956 . . . . 0.0 110.601 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 19.5 mtpt -68.48 -80.25 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.206 -0.934 . . . . 0.0 109.92 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' HIS . . . . . 0.574 ' CG ' ' O ' ' B' ' 44' ' ' HIS . 40.0 p-80 -165.27 120.67 1.34 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.33 -0.856 . . . . 0.0 109.917 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 45' ' ' LYS . . . . . 0.61 ' HB2' ' CE1' ' B' ' 36' ' ' HIS . 15.4 mmtt -115.65 -133.4 0.33 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.233 -0.917 . . . . 0.0 110.276 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' B' ' 9' ' ' GLY . 76.8 p -130.96 106.9 8.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.041 -1.037 . . . . 0.0 110.614 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.502 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -40.21 157.1 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.4 -0.812 . . . . 0.0 110.399 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.502 HG13 ' C ' ' B' ' 47' ' ' ALA . 20.0 mt -143.96 168.21 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.398 -0.814 . . . . 0.0 110.102 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 49' ' ' VAL . . . . . 0.414 HG13 ' N ' ' B' ' 50' ' ' THR . 0.3 OUTLIER -147.46 -179.8 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.11 -0.993 . . . . 0.0 110.254 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.439 ' O ' ' OG ' ' B' ' 32' ' ' SER . 89.9 m -146.41 156.76 43.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.0 109.852 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.509 HD21 ' CE2' ' B' ' 21' ' ' PHE . 1.6 mt -134.62 125.33 26.96 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.983 -1.073 . . . . 0.0 110.123 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.87 134.31 41.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.283 -0.886 . . . . 0.0 110.482 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.501 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 47.3 m-85 -120.29 155.01 34.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.289 -0.882 . . . . 0.0 110.243 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -86.39 -10.67 53.87 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.235 -0.916 . . . . 0.0 110.521 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.07 150.25 18.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 0.0 110.567 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 25.9 mt-10 -63.62 -39.14 93.62 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.254 -0.904 . . . . 0.0 109.938 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 57' ' ' TRP . . . . . 0.421 ' O ' ' HG3' ' B' ' 61' ' ' GLN . 62.2 t-105 -53.6 -52.18 60.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.226 -0.922 . . . . 0.0 109.851 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -57.3 -35.64 70.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.38 -0.825 . . . . 0.0 110.621 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 22.1 ttp85 -59.68 -50.02 75.49 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.088 -1.008 . . . . 0.0 110.956 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -60.97 -33.36 73.09 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.249 -0.907 . . . . 0.0 110.817 -179.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' B' ' 57' ' ' TRP . 35.4 mt-30 -65.64 -47.32 75.98 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.085 -1.01 . . . . 0.0 110.368 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.984 ' O ' HG22 ' B' ' 66' ' ' VAL . 0.8 OUTLIER -55.67 -43.89 76.76 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 109.971 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 87.0 mt -59.28 -35.56 73.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.298 -0.877 . . . . 0.0 110.474 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.8 t -77.83 -18.65 56.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.24 -0.912 . . . . 0.0 110.315 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -94.65 -9.81 33.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.115 -0.99 . . . . 0.0 110.566 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.984 HG22 ' O ' ' B' ' 62' ' ' PHE . 27.6 m -141.89 93.28 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 120.962 -1.086 . . . . 0.0 110.565 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.531 ' O ' ' HG3' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -76.33 113.13 13.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.228 -0.92 . . . . 0.0 110.081 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.897 HG22 ' HD2' ' B' ' 69' ' ' PRO . 0.0 OUTLIER -89.56 162.63 35.92 Favored Pre-proline 0 N--CA 1.497 1.891 0 O-C-N 121.153 -0.967 . . . . 0.0 109.611 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.897 ' HD2' HG22 ' B' ' 68' ' ' ILE . 46.2 Cg_endo -60.64 -177.25 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.841 1.443 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -93.51 -5.56 48.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.17 -0.956 . . . . 0.0 110.368 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 88.0 m -84.59 -20.38 31.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.193 -0.942 . . . . 0.0 110.002 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.547 ' CG2' ' HG ' ' B' ' 7' ' ' LEU . 36.6 mt -94.67 107.46 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.333 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 88.9 m -95.33 157.28 15.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.394 -0.816 . . . . 0.0 110.881 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.732 ' CG2' HG13 ' B' ' 5' ' ' VAL . 8.2 p -141.96 130.51 22.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 CA-C-O 121.948 0.88 . . . . 0.0 111.188 -178.71 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.78 171.42 7.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.352 0.596 . . . . 0.0 110.554 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 33.4 p -110.29 145.37 37.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.322 -0.862 . . . . 0.0 109.848 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -156.12 176.48 33.55 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -147.87 147.62 29.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.241 -1.152 . . . . 0.0 110.179 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.471 ' SD ' HG21 ' B' ' 4' ' ' ILE . 24.4 mtt -120.91 177.81 4.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.298 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.9 t -140.51 107.15 5.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.917 . . . . 0.0 110.358 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.198 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.247 0.546 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.34 150.89 77.74 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 46.4 Cg_endo -100.99 145.78 0.31 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.886 1.466 . . . . 0.0 110.313 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.78 167.68 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 110.145 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.1 t -145.91 130.29 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.201 -0.937 . . . . 0.0 110.413 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.541 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.8 m170 -105.98 125.16 50.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 109.959 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 HD11 ' A' ' 51' ' ' LEU . 1.9 pp -121.92 146.77 46.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.084 -1.01 . . . . 0.0 110.478 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.611 ' O ' HD13 ' A' ' 72' ' ' ILE . 12.4 ttmm -139.35 161.96 36.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.22 -0.925 . . . . 0.0 110.483 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.45 -165.93 38.13 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -65.05 140.37 58.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -1.217 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.455 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.42 -49.81 53.76 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 110.498 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -64.54 -43.53 93.7 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.279 -0.888 . . . . 0.0 110.845 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.7 m -57.81 -24.84 59.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.127 -0.983 . . . . 0.0 110.433 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.495 HD22 HD11 ' A' ' 7' ' ' LEU . 46.6 mt -79.75 -30.94 40.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.885 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -59.49 -41.82 90.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.478 -0.764 . . . . 0.0 110.558 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.53 -37.13 76.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.301 -0.874 . . . . 0.0 110.603 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 14' ' ' LEU . 11.9 mt -59.07 -52.36 66.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.154 -0.967 . . . . 0.0 110.613 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -45.24 -31.39 1.5 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.679 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -64.82 -40.69 95.59 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.246 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -66.91 -35.92 81.08 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.1 m-30 -66.45 -35.38 80.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 110.32 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -63.43 -40.57 97.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -75.01 -37.85 61.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.0 110.318 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.632 ' O ' ' N ' ' A' ' 26' ' ' THR . 90.7 m-70 -95.44 33.75 1.55 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.163 -0.961 . . . . 0.0 110.443 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.579 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 32.0 p -59.36 53.36 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.489 -0.757 . . . . 0.0 111.275 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.632 ' N ' ' O ' ' A' ' 24' ' ' HIS . 14.8 p -144.42 34.63 1.18 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.936 -1.102 . . . . 0.0 109.853 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.7 HD23 ' HG3' ' A' ' 58' ' ' GLN . 10.4 mt -146.77 -21.69 0.42 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.194 -0.941 . . . . 0.0 111.382 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.62 ' CE2' ' CG2' ' A' ' 31' ' ' VAL . 39.8 p90 -115.42 166.64 11.66 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.442 -1.411 . . . . 0.0 109.56 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.85 -32.33 10.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.923 -1.111 . . . . 0.0 111.514 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.605 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.45 117.7 2.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.801 -1.187 . . . . 0.0 111.111 -179.442 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.62 ' CG2' ' CE2' ' A' ' 28' ' ' TYR . 5.1 t -89.84 102.16 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 110.025 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.595 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 5.0 p -69.39 147.05 51.54 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.482 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.35 161.1 9.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 110.226 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.558 ' HA ' HG22 ' A' ' 49' ' ' VAL . 3.0 t -68.28 140.79 55.99 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.383 -0.823 . . . . 0.0 110.753 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.605 ' CE3' ' HB2' ' B' ' 32' ' ' SER . 63.2 p-90 -146.95 -176.1 5.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.405 -0.809 . . . . 0.0 109.418 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.54 ' HB2' ' HA ' ' A' ' 46' ' ' SER . 2.5 p-80 -162.57 174.32 12.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.89 -1.131 . . . . 0.0 111.047 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.597 ' O ' HG21 ' A' ' 42' ' ' VAL . 57.7 m95 -79.13 118.46 21.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.538 -0.726 . . . . 0.0 110.09 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.0 m -89.1 87.57 7.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.334 -0.854 . . . . 0.0 110.306 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -132.33 162.15 23.97 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -53.2 -62.14 1.85 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.247 -1.149 . . . . 0.0 110.004 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -91.06 90.5 7.87 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.327 -0.858 . . . . 0.0 110.032 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.597 HG21 ' O ' ' A' ' 37' ' ' TRP . 8.0 p -145.8 17.2 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.0 110.368 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.5 tttp -56.25 -17.71 8.32 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.231 -0.918 . . . . 0.0 109.998 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 31.7 m80 -54.26 -68.28 0.19 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.83 . . . . 0.0 110.045 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.4 mmtt -122.15 168.84 11.5 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.283 -0.885 . . . . 0.0 110.055 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.54 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 73.3 p -170.14 37.54 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.195 -0.941 . . . . 0.0 110.168 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -167.2 110.16 0.68 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.214 -0.929 . . . . 0.0 110.418 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' TRP . 16.8 mt -142.74 141.85 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.297 -0.877 . . . . 0.0 109.958 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.558 HG22 ' HA ' ' A' ' 34' ' ' THR . 91.7 t -124.37 122.75 64.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.083 -1.011 . . . . 0.0 110.427 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.5 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 20.7 m -94.37 157.32 16.08 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.289 -0.882 . . . . 0.0 110.116 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.522 HD11 HD23 ' A' ' 7' ' ' LEU . 1.2 mt -135.32 130.98 35.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.254 -0.904 . . . . 0.0 110.198 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.605 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 63.4 p -96.76 127.29 42.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.237 -0.914 . . . . 0.0 110.464 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.556 ' OH ' ' CE2' ' A' ' 62' ' ' PHE . 27.4 m-85 -103.78 146.39 28.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 110.026 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 -9.68 55.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.175 -0.953 . . . . 0.0 110.769 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.9 p -162.62 134.98 5.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.068 -1.02 . . . . 0.0 110.591 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.409 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -51.93 -40.16 60.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.292 -0.88 . . . . 0.0 109.848 179.64 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 4.7 t-105 -53.55 -55.27 27.04 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.441 -0.787 . . . . 0.0 109.995 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.7 ' HG3' HD23 ' A' ' 27' ' ' LEU . 16.3 tt0 -57.03 -35.37 69.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.332 -0.855 . . . . 0.0 110.39 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.479 ' O ' ' HB3' ' A' ' 62' ' ' PHE . 7.3 ttp85 -59.52 -33.48 71.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.096 -1.003 . . . . 0.0 109.992 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -61.53 -60.8 3.14 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.359 -0.838 . . . . 0.0 111.305 -179.501 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.524 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 4.1 pm0 -65.14 -18.85 65.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.006 -1.059 . . . . 0.0 110.758 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.599 ' O ' HG22 ' A' ' 66' ' ' VAL . 38.4 t80 -57.25 -65.01 0.7 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.009 -1.057 . . . . 0.0 110.401 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.577 ' HA ' HG22 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -59.51 -39.86 85.2 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.478 -0.764 . . . . 0.0 111.312 -179.235 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.51 -22.03 66.68 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.907 -1.121 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.524 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 15.6 mm-40 -95.37 -30.54 13.86 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.344 -0.848 . . . . 0.0 109.967 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.799 ' O ' HG23 ' A' ' 66' ' ' VAL . 15.1 m -97.91 85.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.302 -0.874 . . . . 0.0 109.72 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.47 ' C ' ' O ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -38.44 105.77 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.342 -0.849 . . . . 0.0 110.441 -179.639 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.507 ' O ' HG23 ' A' ' 68' ' ' ILE . 10.9 tt -89.53 126.67 57.4 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.532 -0.73 . . . . 0.0 110.17 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.08 -177.81 1.48 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.926 1.487 . . . . 0.0 110.396 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -86.64 -12.79 47.47 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.216 -0.928 . . . . 0.0 110.226 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.74 -11.21 56.28 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 110.165 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.611 HD13 ' O ' ' A' ' 8' ' ' LYS . 9.8 mm -94.37 121.33 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.16 -0.962 . . . . 0.0 109.96 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.3 m -95.23 136.09 36.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.05 -1.031 . . . . 0.0 109.818 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.2 t -88.75 156.97 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.055 -1.028 . . . . 0.0 110.871 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.541 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 1.2 m -142.73 154.83 44.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.833 -0.542 . . . . 0.0 110.341 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.1 p -133.0 134.98 45.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.075 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.6 -175.57 30.71 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -148.1 152.78 37.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.206 -1.173 . . . . 0.0 110.528 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -123.74 169.69 11.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.334 -0.854 . . . . 0.0 109.949 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.713 ' C ' HD12 ' A' ' 81' ' ' ILE . 9.6 t -150.22 99.65 2.82 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.244 -0.91 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.713 HD12 ' C ' ' A' ' 80' ' ' SER . 1.1 mp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.051 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.306 0.574 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.2 150.45 76.54 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.25 -0.906 . . . . 0.0 110.094 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.507 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.2 Cg_endo -100.19 145.59 0.38 Allowed 'Trans proline' 0 C--N 1.304 -1.791 0 O-C-N 123.94 1.494 . . . . 0.0 110.187 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.72 168.09 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.02 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -146.12 130.35 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.93 . . . . 0.0 110.426 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.569 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.7 m170 -106.09 125.64 51.23 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.297 -0.877 . . . . 0.0 109.782 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.517 HD23 HD11 ' B' ' 51' ' ' LEU . 1.9 pp -122.76 147.26 46.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.987 -1.071 . . . . 0.0 110.536 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.625 ' O ' HD13 ' B' ' 72' ' ' ILE . 12.4 ttmm -139.61 162.03 36.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.288 -0.882 . . . . 0.0 110.465 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.84 -166.38 38.57 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -64.93 140.18 58.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -1.172 . . . . 0.0 110.252 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.453 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.97 -49.56 49.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -65.0 -43.52 92.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.828 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 75.5 m -57.64 -24.28 55.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.184 -0.948 . . . . 0.0 110.504 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.479 HD22 HD11 ' B' ' 7' ' ' LEU . 41.7 mt -80.82 -30.64 35.78 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.155 -0.966 . . . . 0.0 109.918 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -59.42 -41.91 90.6 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.406 -0.808 . . . . 0.0 110.45 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -69.78 -37.27 76.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.369 -0.832 . . . . 0.0 110.605 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 mt -58.82 -51.55 69.54 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.033 -1.042 . . . . 0.0 110.297 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.5 ttp85 -45.49 -31.69 1.88 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.291 -0.88 . . . . 0.0 110.582 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -64.78 -40.6 95.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.109 -0.994 . . . . 0.0 110.239 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -67.15 -35.76 80.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.145 -0.972 . . . . 0.0 110.156 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.427 ' N ' ' CD1' ' B' ' 21' ' ' PHE . 10.1 m-30 -66.43 -35.11 79.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -63.51 -40.87 98.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.313 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -75.02 -38.03 61.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.165 -0.96 . . . . 0.0 110.452 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.633 ' O ' ' N ' ' B' ' 26' ' ' THR . 91.3 m-70 -95.25 33.8 1.51 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.202 -0.936 . . . . 0.0 110.348 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.594 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 32.0 p -59.34 53.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.536 -0.727 . . . . 0.0 111.318 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.633 ' N ' ' O ' ' B' ' 24' ' ' HIS . 9.3 p -144.38 34.73 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.908 -1.12 . . . . 0.0 109.822 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.678 HD23 ' HG3' ' B' ' 58' ' ' GLN . 10.9 mt -146.9 -21.47 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.181 -0.949 . . . . 0.0 111.356 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.594 ' CE1' ' HA ' ' B' ' 25' ' ' CYS . 39.5 p90 -115.45 166.73 11.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.604 -1.31 . . . . 0.0 109.558 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -32.6 10.57 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.941 -1.099 . . . . 0.0 111.583 -179.13 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.598 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.58 118.07 2.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.816 -1.177 . . . . 0.0 111.08 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.593 ' CG2' ' CE2' ' B' ' 28' ' ' TYR . 4.6 t -89.91 101.08 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.361 -0.837 . . . . 0.0 110.086 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.605 ' HB2' ' CE3' ' A' ' 35' ' ' TRP . 5.5 p -67.85 146.78 53.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.075 -1.016 . . . . 0.0 110.438 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.38 161.6 9.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.221 -0.925 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.564 ' HA ' HG22 ' B' ' 49' ' ' VAL . 3.5 t -68.27 140.38 55.99 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.3 -0.875 . . . . 0.0 110.628 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.595 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 62.8 p-90 -147.03 -176.43 5.21 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.369 -0.832 . . . . 0.0 109.542 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.539 ' HB2' ' HA ' ' B' ' 46' ' ' SER . 2.6 p-80 -162.44 174.4 12.77 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.839 -1.163 . . . . 0.0 111.121 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.597 ' O ' HG21 ' B' ' 42' ' ' VAL . 56.8 m95 -79.21 118.34 21.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.447 -0.783 . . . . 0.0 110.183 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 20.4 m -89.1 88.3 7.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.322 -0.861 . . . . 0.0 110.248 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.28 161.71 24.22 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -52.67 -62.71 1.47 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.283 -1.128 . . . . 0.0 110.072 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -90.64 91.12 8.27 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.086 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.597 HG21 ' O ' ' B' ' 37' ' ' TRP . 8.9 p -146.04 15.23 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.235 -0.916 . . . . 0.0 110.194 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 36.7 tttp -54.42 -17.9 3.6 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.229 -0.919 . . . . 0.0 110.052 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 30.9 m80 -54.51 -67.9 0.23 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.283 -0.886 . . . . 0.0 110.215 179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 39.0 mmtt -122.55 166.57 14.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.27 -0.894 . . . . 0.0 110.248 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.539 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . 75.0 p -167.65 35.87 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.274 -0.891 . . . . 0.0 110.484 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -165.68 110.72 0.86 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.097 -1.002 . . . . 0.0 110.504 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 35' ' ' TRP . 15.9 mt -142.61 142.05 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.415 -0.803 . . . . 0.0 109.996 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 49' ' ' VAL . . . . . 0.564 HG22 ' HA ' ' B' ' 34' ' ' THR . 88.9 t -124.47 121.91 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.069 -1.019 . . . . 0.0 110.209 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.569 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 18.1 m -93.8 157.7 16.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.933 . . . . 0.0 109.953 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.517 HD11 HD23 ' B' ' 7' ' ' LEU . 1.2 mt -135.26 131.53 36.7 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.114 -0.991 . . . . 0.0 110.266 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.598 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 56.6 p -97.06 127.52 43.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.372 -0.83 . . . . 0.0 110.51 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.52 ' OH ' ' CE2' ' B' ' 62' ' ' PHE . 28.7 m-85 -104.32 146.43 28.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.892 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.63 -8.65 57.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 110.805 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 73.1 p -163.83 135.21 4.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.067 -1.02 . . . . 0.0 110.585 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.95 -40.27 60.59 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.86 . . . . 0.0 109.961 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -53.42 -54.99 28.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.333 -0.854 . . . . 0.0 109.894 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.678 ' HG3' HD23 ' B' ' 27' ' ' LEU . 17.4 tt0 -57.02 -36.0 69.93 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.386 -0.821 . . . . 0.0 110.455 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' B' ' 62' ' ' PHE . 6.4 ttp180 -59.54 -33.17 71.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.971 -1.081 . . . . 0.0 110.128 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' B' ' 63' ' ' LEU . 0.3 OUTLIER -61.48 -60.81 3.14 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.394 -0.816 . . . . 0.0 111.205 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.526 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 4.2 pm0 -65.17 -19.14 65.83 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.902 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.612 ' O ' HG22 ' B' ' 66' ' ' VAL . 36.2 t80 -57.02 -65.35 0.63 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.055 -1.028 . . . . 0.0 110.36 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.58 ' HA ' HG22 ' B' ' 66' ' ' VAL . 0.4 OUTLIER -59.36 -39.37 83.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.452 -0.78 . . . . 0.0 111.305 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.87 -21.82 66.49 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.859 -1.151 . . . . 0.0 110.292 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 15.4 mm-40 -95.42 -30.95 13.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.896 . . . . 0.0 109.985 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.797 HG23 ' O ' ' B' ' 66' ' ' VAL . 16.6 m -97.42 85.49 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 109.895 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.466 ' C ' ' O ' ' B' ' 66' ' ' VAL . 0.1 OUTLIER -37.84 105.92 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.421 -0.8 . . . . 0.0 110.56 -179.711 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.503 ' O ' HG23 ' B' ' 68' ' ' ILE . 10.3 tt -89.89 126.7 56.62 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.359 -0.838 . . . . 0.0 110.182 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -67.93 -177.88 1.46 Allowed 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 124.018 1.536 . . . . 0.0 110.32 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -86.74 -12.85 47.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.248 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -11.58 55.42 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 110.216 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.625 HD13 ' O ' ' B' ' 8' ' ' LYS . 9.8 mm -94.3 121.41 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.217 -0.927 . . . . 0.0 109.898 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.0 m -95.41 136.35 35.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.018 -1.052 . . . . 0.0 109.937 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 11.1 t -88.55 156.92 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.029 -1.045 . . . . 0.0 111.074 -178.287 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 75' ' ' SER . . . . . 0.543 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 1.4 m -142.52 154.76 44.77 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.75 -0.594 . . . . 0.0 110.402 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.0 p -133.1 134.68 44.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.175 -0.953 . . . . 0.0 110.103 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.51 -175.62 30.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -147.88 153.01 38.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.177 -1.19 . . . . 0.0 110.509 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -124.12 168.6 12.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.272 -0.892 . . . . 0.0 110.039 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.721 ' C ' HD12 ' B' ' 81' ' ' ILE . 9.2 t -149.08 99.87 3.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.145 -0.972 . . . . 0.0 110.417 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.721 HD12 ' C ' ' B' ' 80' ' ' SER . 1.1 mp . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 118.035 -0.984 . . . . 0.0 109.969 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.455 ' HB3' ' CD2' ' A' ' 78' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.246 0.546 . . . . 0.0 110.152 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -146.39 170.89 7.13 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.212 -0.93 . . . . 0.0 110.303 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 51.9 Cg_endo -104.61 145.6 0.13 Allowed 'Trans proline' 0 C--N 1.307 -1.638 0 O-C-N 124.034 1.544 . . . . 0.0 110.308 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.511 HD11 ' SD ' ' B' ' 79' ' ' MET . 2.8 pt -143.82 162.63 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.212 -0.93 . . . . 0.0 110.041 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.534 HG23 HG22 ' A' ' 74' ' ' VAL . 9.6 p -145.78 127.47 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 0.0 110.074 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.613 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.1 m170 -104.13 118.32 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.348 -0.845 . . . . 0.0 110.135 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.626 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.3 pp -111.54 150.91 29.31 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.127 -0.983 . . . . 0.0 110.222 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.517 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 7.6 tptm -138.71 159.27 42.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 110.482 -179.132 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.517 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 170.67 -174.56 44.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.482 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 40.2 m-20 -65.05 141.49 58.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.153 -1.204 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.33 -69.28 0.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.238 -0.914 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -47.78 -44.96 28.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.065 -1.022 . . . . 0.0 110.385 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.482 ' HB ' ' HB2' ' A' ' 10' ' ' ASP . 41.4 m -58.22 -22.81 53.55 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.257 -0.902 . . . . 0.0 110.61 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 62.8 mt -78.39 -29.79 47.46 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.179 -0.951 . . . . 0.0 110.532 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -59.71 -34.44 72.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.211 -0.931 . . . . 0.0 110.417 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.504 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.9 t -70.27 -46.13 64.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.358 -0.839 . . . . 0.0 110.943 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.8 mp -58.82 -52.76 64.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.057 -1.027 . . . . 0.0 110.59 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.413 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 10.5 ttm180 -45.04 -24.69 0.25 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.221 -0.924 . . . . 0.0 110.516 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.504 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 40.1 t80 -64.8 -40.46 95.26 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.078 -1.014 . . . . 0.0 110.234 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -72.88 -21.18 60.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 110.134 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 8.6 m-30 -66.26 -31.32 72.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 109.954 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -63.57 -33.98 76.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.338 -0.851 . . . . 0.0 110.336 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -75.08 -35.15 61.82 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.245 -0.909 . . . . 0.0 110.41 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.643 ' HB3' HD12 ' A' ' 27' ' ' LEU . 73.4 m-70 -94.48 40.93 1.09 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.243 -0.91 . . . . 0.0 110.12 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.581 ' SG ' HG23 ' A' ' 26' ' ' THR . 27.3 p -57.65 -21.52 40.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.355 -0.841 . . . . 0.0 110.512 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.581 HG23 ' SG ' ' A' ' 25' ' ' CYS . 69.2 p -96.52 10.91 36.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.095 -1.003 . . . . 0.0 110.499 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.643 HD12 ' HB3' ' A' ' 24' ' ' HIS . 2.3 mt -92.26 -49.39 6.2 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 110.16 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.467 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 4.4 p90 -98.9 168.56 10.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.247 -0.908 . . . . 0.0 110.236 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.1 m -98.92 -31.35 11.87 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.848 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.08 116.09 2.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.011 -1.056 . . . . 0.0 110.608 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.409 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.2 p -90.2 135.06 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.883 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.486 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -108.37 154.25 22.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.083 -1.011 . . . . 0.0 110.689 -179.689 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.35 162.56 7.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.359 -0.838 . . . . 0.0 110.265 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.2 t -68.14 131.06 44.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.26 -0.9 . . . . 0.0 110.751 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.556 ' HB3' ' CB ' ' B' ' 35' ' ' TRP . 3.9 p-90 -146.93 157.51 43.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.353 -0.842 . . . . 0.0 109.405 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.484 ' CG ' ' HB3' ' A' ' 46' ' ' SER . 2.3 p-80 -162.58 -173.73 3.67 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.823 -1.173 . . . . 0.0 111.354 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.6 m95 -79.97 138.82 37.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.66 -0.65 . . . . 0.0 110.114 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.46 31.17 6.58 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 110.408 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -83.5 -128.54 1.44 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 20.6 p80 -112.82 -1.95 14.51 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.246 -1.15 . . . . 0.0 110.027 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.437 ' C ' HG13 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -85.33 45.46 1.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.85 . . . . 0.0 110.377 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 42' ' ' VAL . 28.3 m -149.13 119.27 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.326 -0.859 . . . . 0.0 110.065 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -47.12 -49.66 21.64 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.894 . . . . 0.0 110.21 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -140.38 -72.76 0.36 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.205 -0.935 . . . . 0.0 110.061 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm -131.47 -155.53 0.7 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.252 -0.905 . . . . 0.0 109.761 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.484 ' HB3' ' CG ' ' A' ' 36' ' ' HIS . 40.6 t -171.77 -179.4 2.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.966 -1.084 . . . . 0.0 110.471 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.413 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -173.73 118.75 0.28 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.333 -0.855 . . . . 0.0 109.968 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.626 HG23 ' O ' ' A' ' 7' ' ' LEU . 74.1 mt -145.03 133.76 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.326 -0.859 . . . . 0.0 110.123 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.423 ' O ' ' CD2' ' A' ' 7' ' ' LEU . 19.1 t -119.73 130.27 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.049 -1.032 . . . . 0.0 110.442 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.58 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 3.0 m -94.16 156.41 16.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.336 -0.853 . . . . 0.0 110.234 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.498 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 1.0 OUTLIER -135.01 129.98 34.97 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.245 -0.909 . . . . 0.0 109.637 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.11 130.94 44.32 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.217 -0.927 . . . . 0.0 110.675 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HG2' ' A' ' 3' ' ' PRO . 49.0 m-85 -118.48 155.79 30.21 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.383 -0.823 . . . . 0.0 109.956 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.69 -10.32 59.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 110.32 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.9 p -170.26 166.19 8.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.168 -0.958 . . . . 0.0 110.305 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.44 -34.96 73.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.344 -0.848 . . . . 0.0 110.171 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -53.79 -50.82 65.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.342 -0.848 . . . . 0.0 110.12 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 19.1 tt0 -57.95 -38.04 75.25 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.251 -0.906 . . . . 0.0 110.855 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.582 ' HE ' HD11 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -59.18 -44.31 92.17 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.003 -1.06 . . . . 0.0 110.745 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.441 ' HA ' HD12 ' A' ' 63' ' ' LEU . 46.7 t0 -61.01 -38.58 86.6 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.104 -0.998 . . . . 0.0 110.518 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -65.92 -41.49 91.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.134 -0.979 . . . . 0.0 110.725 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.897 ' O ' HG22 ' A' ' 66' ' ' VAL . 2.7 t80 -55.85 -47.4 77.35 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.582 HD11 ' HE ' ' A' ' 59' ' ' ARG . 13.5 mt -59.44 -44.66 92.9 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.256 -0.903 . . . . 0.0 110.459 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -21.45 66.54 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.254 -0.904 . . . . 0.0 110.63 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -95.44 -25.26 16.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.085 -1.01 . . . . 0.0 110.369 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.897 HG22 ' O ' ' A' ' 62' ' ' PHE . 31.2 m -103.64 105.06 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.892 . . . . 0.0 110.036 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -51.4 97.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.192 -0.943 . . . . 0.0 110.395 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.618 ' O ' HG23 ' A' ' 68' ' ' ILE . 9.4 tp -88.66 117.5 68.39 Favored Pre-proline 0 N--CA 1.487 1.424 0 O-C-N 121.169 -0.957 . . . . 0.0 109.979 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.689 ' CG ' HD12 ' A' ' 72' ' ' ILE . 46.2 Cg_endo -60.58 167.97 7.45 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.916 1.482 . . . . 0.0 110.852 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -79.53 -12.98 59.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.45 -0.782 . . . . 0.0 110.315 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.61 -23.73 29.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.27 -0.894 . . . . 0.0 110.227 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.689 HD12 ' CG ' ' A' ' 69' ' ' PRO . 66.0 mt -93.68 115.27 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.913 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.3 m -95.09 142.48 27.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.323 -0.861 . . . . 0.0 110.727 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.616 HG22 ' H ' ' A' ' 75' ' ' SER . 6.0 p -92.25 178.49 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.421 -0.799 . . . . 0.0 110.582 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.616 ' H ' HG22 ' A' ' 74' ' ' VAL . 0.6 OUTLIER -143.85 158.76 43.47 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.499 179.216 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.6 p -133.86 135.12 43.5 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.231 -0.918 . . . . 0.0 110.058 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -160.74 177.03 37.31 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.455 ' CD2' ' HB3' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.93 120.43 8.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.287 -1.125 . . . . 0.0 109.969 -179.802 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.518 ' SD ' HD11 ' B' ' 4' ' ' ILE . 18.3 mmm -95.13 171.74 8.55 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.051 -1.031 . . . . 0.0 110.576 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.422 ' O ' HG23 ' A' ' 81' ' ' ILE . 86.3 p -153.67 107.81 3.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.33 -0.856 . . . . 0.0 110.305 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.422 HG23 ' O ' ' A' ' 80' ' ' SER . 4.6 pt . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.225 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.487 ' CG ' ' O ' ' B' ' 79' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.198 0.523 . . . . 0.0 110.11 . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.5 t -146.13 171.96 5.84 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.262 -0.899 . . . . 0.0 110.103 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.499 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 51.1 Cg_endo -106.13 145.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.847 1.446 . . . . 0.0 110.054 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.518 HD11 ' SD ' ' A' ' 79' ' ' MET . 2.7 pt -143.83 162.79 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.253 -0.904 . . . . 0.0 110.04 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.562 HG23 HG22 ' B' ' 74' ' ' VAL . 8.6 p -145.67 127.84 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.336 -0.853 . . . . 0.0 110.08 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.614 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 1.5 m170 -104.66 118.19 35.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.355 -0.841 . . . . 0.0 110.148 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.649 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.3 pp -111.35 150.93 29.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 110.219 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.522 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 7.7 tptm -138.56 159.53 41.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 110.381 -179.13 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.522 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 170.23 -174.55 44.3 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 10' ' ' ASP . . . . . 0.485 ' HB2' ' HB ' ' B' ' 13' ' ' THR . 40.6 m-20 -65.12 141.83 58.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.126 -1.22 . . . . 0.0 110.291 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.37 -69.4 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.315 -0.865 . . . . 0.0 110.524 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -47.54 -45.49 26.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.156 -0.965 . . . . 0.0 110.528 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.485 ' HB ' ' HB2' ' B' ' 10' ' ' ASP . 37.2 m -58.14 -22.09 49.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 110.723 -179.677 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 65.2 mt -78.83 -29.69 44.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.141 -0.975 . . . . 0.0 110.487 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -59.82 -34.4 73.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.213 -0.929 . . . . 0.0 110.319 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.506 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 1.6 t -70.31 -46.49 64.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.215 -0.928 . . . . 0.0 110.966 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.64 -52.81 64.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.066 -1.021 . . . . 0.0 110.536 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -45.09 -24.74 0.26 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 110.621 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 41.5 t80 -64.8 -39.7 94.02 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.216 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -73.41 -21.29 60.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.145 -0.972 . . . . 0.0 110.159 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -66.18 -31.43 72.26 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.228 -0.92 . . . . 0.0 109.897 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -63.49 -33.76 76.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.12 -35.16 61.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.175 -0.953 . . . . 0.0 110.436 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.643 ' HB3' HD12 ' B' ' 27' ' ' LEU . 76.0 m-70 -94.84 41.16 1.09 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.942 . . . . 0.0 110.169 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.605 ' SG ' HG23 ' B' ' 26' ' ' THR . 27.5 p -57.32 -21.07 32.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.359 -0.838 . . . . 0.0 110.379 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.605 HG23 ' SG ' ' B' ' 25' ' ' CYS . 69.8 p -96.91 10.63 38.51 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.128 -0.982 . . . . 0.0 110.467 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.643 HD12 ' HB3' ' B' ' 24' ' ' HIS . 2.6 mt -92.23 -49.18 6.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.19 -0.944 . . . . 0.0 110.286 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.478 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 4.3 p90 -98.92 168.45 10.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.5 m -98.78 -31.12 12.04 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.25 -0.906 . . . . 0.0 110.68 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.29 116.44 2.7 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.011 -1.056 . . . . 0.0 110.594 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.411 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.2 p -90.27 135.14 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.304 -0.873 . . . . 0.0 109.663 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.478 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -108.2 154.66 21.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.114 -0.991 . . . . 0.0 110.615 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.39 162.44 7.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.43 -0.794 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 2.1 t -68.24 130.51 43.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.266 -0.896 . . . . 0.0 110.64 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.556 ' CB ' ' HB3' ' A' ' 35' ' ' TRP . 4.3 p-90 -146.83 157.33 43.63 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.287 -0.883 . . . . 0.0 109.368 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.476 ' CG ' ' HB3' ' B' ' 46' ' ' SER . 2.5 p-80 -162.45 -173.68 3.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.866 -1.146 . . . . 0.0 111.359 -179.533 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -79.89 139.94 36.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.686 -0.634 . . . . 0.0 109.995 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.54 30.58 6.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.199 -0.938 . . . . 0.0 110.322 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -82.99 -128.77 1.31 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.344 -1.502 . . . . 0.0 109.344 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 20.2 p80 -112.58 -1.05 14.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.22 -1.165 . . . . 0.0 109.988 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' ASN . . . . . 0.463 ' C ' HG13 ' B' ' 42' ' ' VAL . 0.2 OUTLIER -86.43 46.3 1.33 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.349 -0.844 . . . . 0.0 110.2 179.993 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.562 ' O ' HG23 ' B' ' 42' ' ' VAL . 28.2 m -149.92 118.55 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.266 -0.896 . . . . 0.0 110.051 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -46.84 -49.94 19.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.308 -0.87 . . . . 0.0 110.116 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 1.4 t60 -139.71 -72.11 0.38 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.214 -0.929 . . . . 0.0 110.114 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 12.9 mmtm -132.56 -155.0 0.65 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.265 -0.897 . . . . 0.0 109.84 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.476 ' HB3' ' CG ' ' B' ' 36' ' ' HIS . 43.4 t -172.73 -179.1 2.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.939 -1.101 . . . . 0.0 110.684 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -174.27 118.92 0.24 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.31 -0.869 . . . . 0.0 110.176 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.649 HG23 ' O ' ' B' ' 7' ' ' LEU . 74.7 mt -144.98 133.32 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 109.967 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 49' ' ' VAL . . . . . 0.422 ' O ' ' CD2' ' B' ' 7' ' ' LEU . 16.5 t -119.2 130.37 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.038 -1.039 . . . . 0.0 110.424 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.587 HG23 ' CD2' ' B' ' 6' ' ' HIS . 2.7 m -94.07 157.1 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.308 -0.87 . . . . 0.0 110.27 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.495 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 1.0 OUTLIER -135.51 129.84 33.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 179.614 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.13 131.01 44.31 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.154 -0.966 . . . . 0.0 110.711 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 44.0 m-85 -118.65 155.44 31.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 0.0 110.085 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -70.8 -10.1 58.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.156 -0.965 . . . . 0.0 110.488 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 40.7 p -170.1 166.17 9.13 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.209 -0.932 . . . . 0.0 110.269 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -70.59 -35.1 72.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.182 -0.948 . . . . 0.0 110.236 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.47 -51.04 64.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.403 -0.811 . . . . 0.0 110.224 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 19.5 tt0 -58.02 -37.18 73.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 110.734 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.58 ' HE ' HD11 ' B' ' 63' ' ' LEU . 0.2 OUTLIER -59.55 -44.71 93.18 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.085 -1.01 . . . . 0.0 110.631 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.432 ' HA ' HD12 ' B' ' 63' ' ' LEU . 48.0 t0 -60.94 -38.41 85.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.197 -0.94 . . . . 0.0 110.624 -179.45 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -65.8 -41.44 91.93 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.268 -0.895 . . . . 0.0 110.747 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.912 ' O ' HG22 ' B' ' 66' ' ' VAL . 2.3 t80 -55.96 -47.41 77.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.156 -0.965 . . . . 0.0 110.24 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.58 HD11 ' HE ' ' B' ' 59' ' ' ARG . 13.7 mt -59.48 -43.95 93.14 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.166 -0.959 . . . . 0.0 110.652 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -21.33 66.23 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.204 -0.935 . . . . 0.0 110.628 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.31 -25.27 16.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.157 -0.964 . . . . 0.0 110.296 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.912 HG22 ' O ' ' B' ' 62' ' ' PHE . 32.4 m -103.78 104.81 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.3 -0.875 . . . . 0.0 109.952 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttt -51.34 97.59 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.319 -0.863 . . . . 0.0 110.379 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.595 ' O ' HG23 ' B' ' 68' ' ' ILE . 8.6 tp -88.43 117.77 68.73 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.259 -0.9 . . . . 0.0 109.932 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.713 ' CG ' HD12 ' B' ' 72' ' ' ILE . 48.7 Cg_endo -61.23 168.25 8.03 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.889 1.468 . . . . 0.0 110.594 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -79.98 -12.81 59.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.283 -0.886 . . . . 0.0 110.347 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.53 -23.08 29.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.224 -0.923 . . . . 0.0 110.09 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.713 HD12 ' CG ' ' B' ' 69' ' ' PRO . 67.5 mt -94.21 115.29 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.253 -0.905 . . . . 0.0 110.026 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 7.7 m -95.23 142.38 27.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.33 -0.856 . . . . 0.0 110.839 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.608 HG22 ' H ' ' B' ' 75' ' ' SER . 5.4 p -92.28 178.65 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.278 -0.889 . . . . 0.0 110.52 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 75' ' ' SER . . . . . 0.614 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -144.03 158.64 43.58 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.397 -0.814 . . . . 0.0 110.622 179.125 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.9 p -133.57 134.72 43.67 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 110.129 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.94 176.83 36.62 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.427 ' CD2' ' HB3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -148.06 119.94 8.16 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.316 -1.108 . . . . 0.0 109.82 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.511 ' SD ' HD11 ' A' ' 4' ' ' ILE . 19.1 mmm -94.52 173.08 7.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.971 -1.081 . . . . 0.0 110.472 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.421 ' O ' HG23 ' B' ' 81' ' ' ILE . 85.9 p -154.85 107.16 2.73 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.222 -0.924 . . . . 0.0 110.272 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.421 HG23 ' O ' ' B' ' 80' ' ' SER . 4.8 pt . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 117.921 -1.038 . . . . 0.0 110.262 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.205 0.526 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.5 m -68.61 121.65 81.77 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 121.263 -0.898 . . . . 0.0 110.122 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.512 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 47.1 Cg_endo -69.11 157.17 62.68 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.08 1.568 . . . . 0.0 110.52 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.605 HD11 ' HG2' ' B' ' 79' ' ' MET . 5.1 pt -143.02 169.13 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.231 -0.918 . . . . 0.0 110.031 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.575 ' CG1' HG21 ' A' ' 74' ' ' VAL . 6.4 t -145.8 125.64 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.211 -0.931 . . . . 0.0 110.187 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.47 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -106.19 119.02 38.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.347 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.738 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.4 mp -116.5 147.4 41.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.312 -0.867 . . . . 0.0 110.177 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 1.074 ' O ' HD12 ' A' ' 72' ' ' ILE . 11.5 tttt -142.42 168.5 19.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.214 -0.929 . . . . 0.0 110.388 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.432 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 151.76 -166.02 30.73 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 131.01 45.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.194 -1.18 . . . . 0.0 110.253 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.97 -39.8 41.98 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.28 -0.887 . . . . 0.0 110.726 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -66.08 -46.91 76.02 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.077 -1.015 . . . . 0.0 110.605 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 5.8 m -58.1 -27.77 64.0 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.938 . . . . 0.0 110.367 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.702 HD21 HD13 ' A' ' 72' ' ' ILE . 77.7 mt -77.71 -27.4 50.65 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.969 . . . . 0.0 110.34 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.2 ttmt -59.35 -39.39 83.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.252 -0.905 . . . . 0.0 110.411 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.2 t -70.19 -34.23 72.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.098 -1.001 . . . . 0.0 110.423 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 13' ' ' THR . 5.9 mp -58.94 -51.91 68.01 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.212 -0.93 . . . . 0.0 110.558 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.509 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 1.2 ttp-105 -46.22 -31.86 2.7 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.264 -0.897 . . . . 0.0 110.124 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.49 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 48.4 t80 -65.14 -33.06 75.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.306 -0.871 . . . . 0.0 110.391 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 -74.74 -30.32 61.46 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.203 -0.936 . . . . 0.0 110.465 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.509 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 11.1 m-30 -66.32 -21.58 66.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LYS . . . . . 0.472 ' HE2' ' CB ' ' B' ' 40' ' ' HIS . 29.4 mmtp -63.38 -36.53 84.02 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.615 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -75.1 -40.95 59.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -0.936 . . . . 0.0 110.463 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.626 ' HB3' HD12 ' A' ' 27' ' ' LEU . 15.0 m-70 -95.12 36.52 1.21 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.227 -0.921 . . . . 0.0 110.328 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.607 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 32.0 p -57.44 -17.92 15.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.474 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.95 -3.29 41.99 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.206 -0.934 . . . . 0.0 110.518 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.626 HD12 ' HB3' ' A' ' 24' ' ' HIS . 11.2 mt -92.42 -6.19 50.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.181 -0.949 . . . . 0.0 110.495 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.607 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 22.7 p90 -144.58 -178.08 5.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.194 -0.941 . . . . 0.0 109.528 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 45.6 m -96.47 -68.99 0.77 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.914 -1.116 . . . . 0.0 110.584 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.2 20.79 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.081 -1.012 . . . . 0.0 109.012 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 31' ' ' VAL . 12.7 p -91.29 112.58 25.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 O-C-N 121.681 -0.637 . . . . 0.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.442 ' OG ' ' HB ' ' A' ' 50' ' ' THR . 79.5 p -52.59 152.62 3.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.926 -1.109 . . . . 0.0 109.373 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.417 ' OG ' ' HB2' ' B' ' 35' ' ' TRP . 0.8 OUTLIER -60.93 155.08 20.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.166 -0.959 . . . . 0.0 110.305 -179.651 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -67.64 129.78 40.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.333 -0.855 . . . . 0.0 110.318 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.483 ' HB2' ' OG ' ' B' ' 33' ' ' SER . 44.4 p-90 -146.15 176.15 9.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.189 -0.944 . . . . 0.0 109.921 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.486 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . 53.2 t-80 -162.57 177.83 9.09 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 110.351 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.471 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 80.2 m95 -78.51 123.99 27.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.225 -0.922 . . . . 0.0 110.126 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 m -171.31 159.67 5.84 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.37 -0.831 . . . . 0.0 109.916 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -132.21 -125.98 2.69 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.416 ' HB2' ' CE ' ' B' ' 22' ' ' LYS . 29.9 t-80 -91.2 -40.08 11.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.242 -1.152 . . . . 0.0 110.171 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -135.27 67.02 1.5 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.349 -0.844 . . . . 0.0 110.22 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.522 HG12 ' N ' ' A' ' 43' ' ' LYS . 41.1 t -121.53 171.46 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.284 -0.885 . . . . 0.0 110.196 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.522 ' N ' HG12 ' A' ' 42' ' ' VAL . 36.1 mtpt -94.66 177.63 5.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.303 -0.873 . . . . 0.0 110.197 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 53.6 t60 -115.53 136.18 53.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.271 -0.893 . . . . 0.0 109.893 179.73 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.23 -70.42 0.81 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.19 -0.944 . . . . 0.0 110.533 -179.705 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.497 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.3 OUTLIER -154.16 106.2 2.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.221 -0.925 . . . . 0.0 110.389 -179.845 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.487 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -40.54 157.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.42 -0.8 . . . . 0.0 110.068 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.738 HG23 ' O ' ' A' ' 7' ' ' LEU . 70.3 mt -142.07 144.56 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 110.353 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.535 HG12 ' N ' ' A' ' 50' ' ' THR . 67.5 t -116.79 169.07 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.285 -0.884 . . . . 0.0 110.458 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.535 ' N ' HG12 ' A' ' 49' ' ' VAL . 17.4 m -146.05 152.16 38.89 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.369 -0.832 . . . . 0.0 109.891 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.42 128.78 32.17 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.169 -0.957 . . . . 0.0 110.249 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.47 ' OG1' ' CZ3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.61 40.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.361 -0.837 . . . . 0.0 110.158 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.541 ' CD2' ' HA ' ' A' ' 59' ' ' ARG . 40.2 m-85 -111.91 147.35 36.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.203 -0.936 . . . . 0.0 109.93 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -93.21 -3.28 54.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 110.941 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.1 p -157.66 121.04 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.028 -1.045 . . . . 0.0 110.328 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 2.3 mt-10 -46.32 -42.44 14.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.867 . . . . 0.0 110.132 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 16.0 t-105 -53.66 -56.0 21.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 179.941 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -59.07 -31.21 68.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.291 -0.881 . . . . 0.0 110.629 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.541 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -59.34 -54.55 45.43 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.273 -0.892 . . . . 0.0 111.061 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.0 -31.7 71.3 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.153 -0.967 . . . . 0.0 110.975 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.432 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 36.2 mt-30 -65.64 -46.48 79.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.115 -0.991 . . . . 0.0 110.761 -179.505 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.713 ' O ' HG12 ' A' ' 66' ' ' VAL . 38.4 t80 -56.46 -67.49 0.3 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 111.007 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.606 HD12 ' C ' ' A' ' 63' ' ' LEU . 4.2 pp -59.17 -12.98 5.93 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.227 -0.921 . . . . 0.0 110.98 -179.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 t -88.59 -23.41 23.12 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.036 -1.04 . . . . 0.0 109.97 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 3.6 mm100 -97.67 -44.34 6.81 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.461 -0.774 . . . . 0.0 109.829 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 62' ' ' PHE . 1.8 p -98.45 91.67 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 109.935 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.451 ' C ' HG12 ' A' ' 68' ' ' ILE . 19.1 pttp -65.29 -177.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.44 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.952 HG22 ' HD2' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -151.09 149.92 26.12 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.286 -0.884 . . . . 0.0 109.52 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.952 ' HD2' HG22 ' A' ' 68' ' ' ILE . 44.8 Cg_endo -49.7 -177.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.807 1.425 . . . . 0.0 110.455 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.74 -3.42 42.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.294 -0.879 . . . . 0.0 110.683 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -23.15 29.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.096 -1.002 . . . . 0.0 109.934 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 1.074 HD12 ' O ' ' A' ' 8' ' ' LYS . 2.2 tp -94.58 106.34 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.393 -0.817 . . . . 0.0 110.212 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.5 m -97.34 156.37 16.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.049 -1.032 . . . . 0.0 109.483 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.575 HG21 ' CG1' ' A' ' 5' ' ' VAL . 5.8 p -143.85 138.1 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 118.883 -1.127 . . . . 0.0 111.774 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 -179.22 3.94 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.899 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.6 p -128.33 155.67 44.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.214 -0.929 . . . . 0.0 110.124 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.34 -178.31 41.09 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -147.5 133.34 19.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.396 -1.061 . . . . 0.0 109.909 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.628 ' HG2' HD11 ' B' ' 4' ' ' ILE . 5.0 mtm -118.66 -179.91 3.94 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.242 -0.911 . . . . 0.0 110.55 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' B' ' 76' ' ' THR . 21.6 p -142.41 110.15 5.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.307 -0.871 . . . . 0.0 109.973 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.1 tt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.301 -179.767 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.157 0.503 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.3 m -70.47 121.78 84.51 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.3 Cg_endo -68.84 156.63 64.78 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 124.149 1.605 . . . . 0.0 110.512 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.628 HD11 ' HG2' ' A' ' 79' ' ' MET . 5.1 pt -142.5 168.9 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.349 -0.844 . . . . 0.0 109.887 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.617 HG12 HG21 ' B' ' 74' ' ' VAL . 5.3 t -145.76 124.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.206 -0.934 . . . . 0.0 110.269 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.494 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.64 119.17 38.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.215 -0.928 . . . . 0.0 110.341 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.73 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.3 mp -116.56 147.32 41.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.3 -0.875 . . . . 0.0 110.198 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 1.061 ' O ' HD12 ' B' ' 72' ' ' ILE . 11.6 tttt -142.4 168.71 19.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 110.439 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.434 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 151.61 -165.96 30.65 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 10' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 130.84 44.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -1.124 . . . . 0.0 110.196 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.28 -38.79 42.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.868 . . . . 0.0 110.67 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -66.56 -47.1 73.86 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.185 -0.947 . . . . 0.0 110.515 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.478 ' O ' HD13 ' B' ' 17' ' ' LEU . 7.1 m -58.01 -28.32 64.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.21 -0.931 . . . . 0.0 110.539 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.675 HD21 HD13 ' B' ' 72' ' ' ILE . 77.3 mt -77.37 -26.95 52.37 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 0.0 110.358 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -59.36 -39.67 84.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.194 -0.941 . . . . 0.0 110.343 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.487 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 0.8 OUTLIER -70.2 -34.22 72.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.216 -0.927 . . . . 0.0 110.367 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' B' ' 13' ' ' THR . 6.1 mp -58.8 -51.66 69.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.131 -0.98 . . . . 0.0 110.466 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.487 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 1.3 ttp-105 -46.16 -32.36 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.92 . . . . 0.0 110.098 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.487 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 48.8 t80 -64.91 -33.25 75.56 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -74.53 -30.19 61.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.264 -0.897 . . . . 0.0 110.503 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 11.3 m-30 -66.51 -21.58 66.17 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.208 -0.932 . . . . 0.0 110.459 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 22' ' ' LYS . . . . . 0.416 ' CE ' ' HB2' ' A' ' 40' ' ' HIS . 29.2 mmtp -63.5 -36.24 83.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.255 -0.903 . . . . 0.0 110.592 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -75.12 -40.94 59.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.218 -0.926 . . . . 0.0 110.411 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.621 ' HB3' HD12 ' B' ' 27' ' ' LEU . 15.8 m-70 -95.07 36.28 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.464 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.593 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 31.8 p -57.38 -17.84 14.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.133 -0.98 . . . . 0.0 110.485 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.92 -3.28 42.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.111 -0.993 . . . . 0.0 110.396 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.621 HD12 ' HB3' ' B' ' 24' ' ' HIS . 10.9 mt -92.32 -6.22 50.69 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.556 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.593 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 20.7 p90 -145.04 -178.09 5.87 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.202 -0.936 . . . . 0.0 109.635 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 48.0 m -96.44 -69.19 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.91 -1.119 . . . . 0.0 110.589 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.46 20.99 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.955 -1.091 . . . . 0.0 109.065 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.678 ' O ' HG13 ' B' ' 31' ' ' VAL . 14.3 p -91.37 113.32 26.75 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.938 0 O-C-N 121.712 -0.617 . . . . 0.0 110.39 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.443 ' OG ' ' HB ' ' B' ' 50' ' ' THR . 70.7 p -53.08 152.55 4.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.006 -1.059 . . . . 0.0 109.56 179.404 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 33' ' ' SER . . . . . 0.483 ' OG ' ' HB2' ' A' ' 35' ' ' TRP . 0.9 OUTLIER -60.77 154.45 21.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.014 -1.054 . . . . 0.0 109.98 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -67.63 130.23 42.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.161 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.453 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 44.1 p-90 -146.09 176.04 10.02 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.313 -0.867 . . . . 0.0 109.929 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' B' ' 47' ' ' ALA . 53.7 t-80 -162.55 178.05 8.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.427 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.476 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 79.6 m95 -78.5 123.78 27.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.276 -0.89 . . . . 0.0 110.067 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 1.7 m -171.87 159.44 5.17 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.32 -0.863 . . . . 0.0 109.869 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.7 -125.7 2.69 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 40' ' ' HIS . . . . . 0.472 ' CB ' ' HE2' ' A' ' 22' ' ' LYS . 28.7 t-80 -91.44 -39.73 11.81 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.297 -1.119 . . . . 0.0 110.243 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -135.45 66.73 1.51 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.162 -0.961 . . . . 0.0 110.102 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.521 HG12 ' N ' ' B' ' 43' ' ' LYS . 43.5 t -121.56 170.57 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.268 -0.895 . . . . 0.0 110.123 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.521 ' N ' HG12 ' B' ' 42' ' ' VAL . 33.0 mtpt -94.1 176.86 6.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.271 -0.893 . . . . 0.0 110.237 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -114.82 136.31 53.23 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.287 -0.883 . . . . 0.0 110.045 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -110.37 -70.2 0.82 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -0.968 . . . . 0.0 110.48 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.507 ' O ' HG13 ' B' ' 48' ' ' ILE . 0.2 OUTLIER -154.16 106.41 2.8 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.485 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -40.51 157.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.448 -0.782 . . . . 0.0 110.008 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.73 HG23 ' O ' ' B' ' 7' ' ' LEU . 70.2 mt -142.12 144.29 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.18 -0.95 . . . . 0.0 110.318 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 49' ' ' VAL . . . . . 0.542 HG12 ' N ' ' B' ' 50' ' ' THR . 70.8 t -116.65 169.16 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 0.0 110.498 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.542 ' N ' HG12 ' B' ' 49' ' ' VAL . 17.2 m -146.04 152.96 40.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.295 -0.878 . . . . 0.0 109.804 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -136.01 128.47 30.43 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.132 -0.98 . . . . 0.0 110.232 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.417 ' OG1' ' CZ3' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.93 39.92 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.208 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.541 ' CD2' ' HA ' ' B' ' 59' ' ' ARG . 38.3 m-85 -112.31 147.69 35.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.264 -0.898 . . . . 0.0 110.034 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -93.45 -3.18 53.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.822 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' SER . . . . . 0.413 ' OG ' ' HB2' ' B' ' 58' ' ' GLN . 98.8 p -157.44 121.38 4.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.015 -1.053 . . . . 0.0 110.372 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.479 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 2.3 mt-10 -46.99 -42.18 17.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.314 -0.867 . . . . 0.0 109.978 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 16.1 t-105 -53.94 -55.83 23.38 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.824 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.413 ' HB2' ' OG ' ' B' ' 55' ' ' SER . 17.1 tt0 -59.23 -31.06 68.71 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.408 -0.807 . . . . 0.0 110.52 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.541 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 0.0 OUTLIER -59.41 -54.7 43.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.18 -0.95 . . . . 0.0 110.96 -179.645 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 60' ' ' ASP . . . . . 0.418 ' O ' ' CB ' ' B' ' 64' ' ' SER . 19.6 t70 -61.12 -31.3 71.01 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.174 -0.954 . . . . 0.0 110.893 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.442 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 36.1 mt-30 -65.76 -46.55 78.39 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.116 -0.99 . . . . 0.0 110.668 -179.59 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.705 ' O ' HG12 ' B' ' 66' ' ' VAL . 41.5 t80 -56.43 -67.84 0.27 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.242 -0.911 . . . . 0.0 111.04 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.615 ' C ' HD12 ' B' ' 63' ' ' LEU . 4.1 pp -59.14 -12.93 5.78 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.306 -0.872 . . . . 0.0 110.792 -179.094 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 11.2 t -88.46 -23.36 23.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.172 -0.955 . . . . 0.0 109.901 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 65' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 3.5 mm-40 -98.2 -44.63 6.51 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.444 -0.785 . . . . 0.0 110.02 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.705 HG12 ' O ' ' B' ' 62' ' ' PHE . 1.9 p -98.12 90.9 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.359 -0.838 . . . . 0.0 110.008 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.456 ' C ' HG12 ' B' ' 68' ' ' ILE . 19.0 pttp -64.48 -176.88 0.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.413 -0.804 . . . . 0.0 110.48 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.919 HG22 ' HD2' ' B' ' 69' ' ' PRO . 0.1 OUTLIER -151.44 149.93 25.55 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.405 -0.809 . . . . 0.0 109.682 -179.847 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.919 ' HD2' HG22 ' B' ' 68' ' ' ILE . 45.3 Cg_endo -49.35 -178.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.779 1.41 . . . . 0.0 110.655 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -4.0 43.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.288 -0.882 . . . . 0.0 110.581 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.63 -23.29 29.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.151 -0.968 . . . . 0.0 110.078 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 1.061 HD12 ' O ' ' B' ' 8' ' ' LYS . 1.9 tp -94.47 106.59 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 110.112 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 26.8 m -97.35 156.06 16.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.044 -1.035 . . . . 0.0 109.408 179.021 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.617 HG21 HG12 ' B' ' 5' ' ' VAL . 6.0 p -143.91 138.39 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.85 -1.14 . . . . 0.0 111.63 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -179.37 3.98 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.009 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 76' ' ' THR . . . . . 0.436 ' O ' ' OG ' ' A' ' 80' ' ' SER . 5.5 p -128.19 155.46 44.47 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.01 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.72 -178.32 41.31 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -147.5 133.52 19.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.336 -1.097 . . . . 0.0 110.05 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.605 ' HG2' HD11 ' A' ' 4' ' ' ILE . 5.0 mtm -118.81 179.74 4.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.341 -0.85 . . . . 0.0 110.323 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 21.6 p -142.07 110.17 5.91 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.379 -0.825 . . . . 0.0 109.88 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.402 HG22 ' H ' ' B' ' 81' ' ' ILE . 13.8 tt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.384 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.4 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.222 0.534 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.43 142.65 89.51 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.262 -0.899 . . . . 0.0 110.107 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.46 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 45.3 Cg_endo -92.5 137.22 1.6 Allowed 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.97 1.511 . . . . 0.0 110.227 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.527 HG21 ' SD ' ' A' ' 79' ' ' MET . 1.0 OUTLIER -142.8 176.05 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.861 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.557 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 12.4 p -146.11 153.69 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.199 -0.938 . . . . 0.0 110.466 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.502 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.1 OUTLIER -133.75 108.89 8.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.481 -0.762 . . . . 0.0 109.765 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.656 ' O ' HG23 ' A' ' 48' ' ' ILE . 2.4 pp -120.89 162.44 19.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.685 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.598 ' O ' HG23 ' A' ' 72' ' ' ILE . 31.3 pttt -139.58 166.4 24.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.317 -0.864 . . . . 0.0 110.22 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 167.11 178.72 39.65 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -65.34 136.4 56.48 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.304 -1.116 . . . . 0.0 110.508 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.08 -24.43 2.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.232 -0.917 . . . . 0.0 110.18 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -81.37 -51.38 8.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -57.86 -16.73 12.76 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.286 -0.883 . . . . 0.0 109.905 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 mt -90.89 -28.98 17.77 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -0.838 . . . . 0.0 110.135 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -60.19 -48.83 80.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.277 -0.889 . . . . 0.0 110.675 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.2 t -70.02 -34.91 73.89 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 110.763 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.73 -48.1 82.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.148 -0.97 . . . . 0.0 110.56 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.548 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 72.0 ttt-85 -47.69 -32.51 5.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.648 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -64.12 -25.81 68.26 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.945 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -73.68 -32.93 64.21 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.206 -0.934 . . . . 0.0 109.631 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.57 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 7.2 m-30 -66.72 -8.19 26.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.37 -0.831 . . . . 0.0 110.191 179.643 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.7 mmtt -63.06 -49.82 73.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.157 -0.965 . . . . 0.0 109.856 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -75.29 -25.93 58.33 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.248 -0.907 . . . . 0.0 109.772 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.472 ' HA ' HD13 ' A' ' 27' ' ' LEU . 18.1 m170 -95.27 29.61 2.45 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.377 -0.827 . . . . 0.0 110.018 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 p -57.26 -19.59 22.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.111 -0.993 . . . . 0.0 110.177 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.7 t -97.09 9.32 42.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 24' ' ' HIS . 4.2 mp -92.38 -33.07 14.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.123 -0.986 . . . . 0.0 110.628 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.5 p90 -118.76 168.88 10.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.964 -1.085 . . . . 0.0 110.255 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.67 -31.59 11.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.571 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.77 116.23 2.52 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.152 -0.967 . . . . 0.0 110.582 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.767 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.3 p -90.11 101.57 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.157 -0.964 . . . . 0.0 110.268 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.609 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 54.9 p -50.41 153.02 1.67 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.135 -0.978 . . . . 0.0 110.484 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.573 ' HB3' HG21 ' B' ' 42' ' ' VAL . 91.5 p -61.27 -96.43 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.274 -0.891 . . . . 0.0 110.506 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.471 ' N ' ' OG ' ' A' ' 33' ' ' SER . 3.2 m -171.55 125.19 0.6 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.414 -0.804 . . . . 0.0 110.036 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.56 ' CE3' ' HB2' ' B' ' 32' ' ' SER . 33.6 p-90 -147.09 -168.61 3.09 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.374 -0.829 . . . . 0.0 110.053 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.767 ' HB3' HG11 ' A' ' 42' ' ' VAL . 82.6 t60 -162.64 171.14 17.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.26 -0.9 . . . . 0.0 110.183 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.505 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 4.4 m95 -79.85 99.11 7.37 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.15 -0.969 . . . . 0.0 110.054 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.983 HG21 ' HA ' ' A' ' 42' ' ' VAL . 2.3 m -170.14 -87.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 110.013 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.795 ' N ' HG22 ' A' ' 38' ' ' THR . . . 158.92 -130.61 2.54 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' HIS . . . . . 0.508 ' CG ' ' N ' ' A' ' 41' ' ' ASN . 35.6 p-80 -68.79 -40.18 79.76 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.376 -1.073 . . . . 0.0 110.326 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.639 ' O ' HG21 ' A' ' 38' ' ' THR . 24.0 t-20 -109.44 98.86 8.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.453 -0.78 . . . . 0.0 109.964 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.983 ' HA ' HG21 ' A' ' 38' ' ' THR . 42.5 t -98.15 107.48 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.303 -0.873 . . . . 0.0 110.533 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.486 ' HD3' ' OD1' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -153.81 38.25 0.47 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.316 -0.865 . . . . 0.0 110.405 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -110.91 -69.35 0.87 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.176 -0.952 . . . . 0.0 110.264 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.619 ' HB2' ' CE1' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -98.32 -156.64 0.55 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.236 -0.915 . . . . 0.0 110.354 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 47' ' ' ALA . 2.8 t -97.0 134.4 40.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.035 -1.041 . . . . 0.0 110.954 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.539 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -41.55 163.53 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.479 -0.763 . . . . 0.0 110.168 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.656 HG23 ' O ' ' A' ' 7' ' ' LEU . 64.4 mt -142.42 162.13 18.92 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.177 -0.952 . . . . 0.0 110.102 -179.262 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.6 t -135.95 167.98 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.702 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.496 ' OG1' ' CE1' ' A' ' 6' ' ' HIS . 82.9 m -145.99 153.81 41.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.603 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.557 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 0.5 OUTLIER -136.33 136.04 39.37 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.045 -1.035 . . . . 0.0 110.219 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.571 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 0.0 OUTLIER -96.61 125.28 40.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.444 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.46 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 38.1 m-85 -108.83 147.37 32.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 110.133 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -95.37 -16.92 22.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -140.26 126.84 20.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.184 -0.947 . . . . 0.0 110.296 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 4.3 mt-10 -53.99 -42.97 69.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.244 -0.91 . . . . 0.0 110.23 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 t-105 -53.58 -48.31 69.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -58.84 -36.31 74.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.371 -0.831 . . . . 0.0 110.088 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.773 ' NH2' HG22 ' A' ' 76' ' ' THR . 2.2 tmt_? -59.45 -45.51 91.4 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -60.99 -38.25 85.36 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.137 -0.977 . . . . 0.0 110.674 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 43.7 mt-30 -65.51 -39.23 91.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 110.53 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.708 ' O ' HG22 ' A' ' 66' ' ' VAL . 30.5 t80 -56.24 -65.2 0.65 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.356 -0.84 . . . . 0.0 111.036 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.739 HD12 ' C ' ' A' ' 63' ' ' LEU . 4.6 pp -59.64 -10.31 3.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.221 -0.924 . . . . 0.0 110.841 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' SER . . . . . 0.512 ' N ' HD12 ' A' ' 63' ' ' LEU . 4.5 t -92.41 -23.61 19.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.098 -1.001 . . . . 0.0 110.699 -179.691 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -95.5 -28.25 14.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.077 -1.015 . . . . 0.0 110.716 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 62' ' ' PHE . 3.5 m -109.37 75.07 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.044 -1.035 . . . . 0.0 110.138 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -50.83 111.57 0.57 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.288 -0.882 . . . . 0.0 110.229 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.499 HG23 ' HB ' ' A' ' 72' ' ' ILE . 0.5 OUTLIER -87.62 139.28 31.47 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 110.065 -179.647 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 68' ' ' ILE . 46.2 Cg_endo -56.5 179.01 0.11 Allowed 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.211 1.637 . . . . 0.0 110.56 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -86.36 -0.62 56.3 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.338 -0.851 . . . . 0.0 110.195 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.0 p -84.42 -30.5 25.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.282 -0.886 . . . . 0.0 109.765 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.598 HG23 ' O ' ' A' ' 8' ' ' LYS . 50.8 mt -94.34 114.76 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.013 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.539 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 7.0 m -95.53 146.08 24.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.195 -0.941 . . . . 0.0 109.933 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.526 ' CG2' ' CG2' ' A' ' 5' ' ' VAL . 8.2 p -145.2 154.32 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.129 -0.982 . . . . 0.0 110.749 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.99 -179.23 5.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 109.876 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.773 HG22 ' NH2' ' A' ' 59' ' ' ARG . 52.4 p -107.09 163.81 12.68 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.381 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -165.45 -177.86 38.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -147.9 144.15 27.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.201 -1.176 . . . . 0.0 110.333 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.527 ' SD ' HG21 ' A' ' 4' ' ' ILE . 97.2 mtp -115.29 172.46 7.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.265 -0.897 . . . . 0.0 110.147 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.473 ' HB3' ' O ' ' B' ' 76' ' ' THR . 2.2 t -132.72 101.76 5.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.937 . . . . 0.0 110.483 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.41 HG23 ' O ' ' A' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.126 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mtp . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.246 0.546 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.97 143.81 92.22 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.266 -0.896 . . . . 0.0 110.27 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.462 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 46.3 Cg_endo -93.4 137.14 1.29 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 O-C-N 124.03 1.542 . . . . 0.0 110.362 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.507 HG21 ' SD ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -143.13 176.73 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.391 -0.818 . . . . 0.0 110.025 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 74' ' ' VAL . 12.3 p -146.44 154.04 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 110.413 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.566 ' HD2' HG23 ' B' ' 50' ' ' THR . 0.2 OUTLIER -133.92 108.42 8.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 0.0 109.667 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.648 ' O ' HG23 ' B' ' 48' ' ' ILE . 2.5 pp -120.55 162.45 19.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.963 . . . . 0.0 110.687 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.616 ' O ' HG23 ' B' ' 72' ' ' ILE . 31.9 pttt -139.69 166.31 24.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.26 -0.9 . . . . 0.0 110.256 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 167.17 178.36 39.45 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -65.02 136.89 57.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.42 -1.047 . . . . 0.0 110.405 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.38 -25.13 3.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.325 -0.859 . . . . 0.0 110.117 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -80.52 -51.61 8.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.317 -0.864 . . . . 0.0 110.188 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 18.6 m -57.87 -16.54 12.14 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.248 -0.907 . . . . 0.0 110.041 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.6 mt -91.16 -28.74 17.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 110.237 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 18.0 ttmt -60.15 -48.67 80.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.29 -0.881 . . . . 0.0 110.638 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -70.15 -34.98 73.7 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.172 -0.955 . . . . 0.0 110.865 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.65 -48.12 82.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.064 -1.023 . . . . 0.0 110.505 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.559 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 71.4 ttt-85 -47.63 -32.64 5.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.593 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -64.28 -25.17 67.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -0.982 . . . . 0.0 109.953 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -74.69 -32.71 62.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.318 -0.864 . . . . 0.0 109.5 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 7.5 m-30 -66.65 -8.17 25.65 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 110.117 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -63.14 -50.09 71.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -75.14 -25.74 58.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.779 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.489 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 18.1 m170 -95.34 29.34 2.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.366 -0.834 . . . . 0.0 110.14 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 14.3 p -57.04 -19.73 20.6 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.104 -0.997 . . . . 0.0 110.208 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -97.06 9.54 41.82 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.851 . . . . 0.0 110.209 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.489 ' HB2' ' O ' ' B' ' 24' ' ' HIS . 4.2 mp -92.31 -34.13 14.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.22 -0.925 . . . . 0.0 110.564 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -117.9 168.92 10.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.005 -1.06 . . . . 0.0 110.417 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.71 -31.48 11.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.312 -0.867 . . . . 0.0 110.828 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.589 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.67 116.47 2.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.054 -1.029 . . . . 0.0 110.58 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.778 ' O ' HG13 ' B' ' 31' ' ' VAL . 12.0 p -90.27 101.12 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.116 -0.99 . . . . 0.0 110.333 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.56 ' HB2' ' CE3' ' A' ' 35' ' ' TRP . 60.0 p -50.38 152.51 1.82 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.081 -1.012 . . . . 0.0 110.376 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 33' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' B' ' 34' ' ' THR . 85.6 p -61.23 -95.93 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.884 . . . . 0.0 110.5 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.514 ' N ' ' OG ' ' B' ' 33' ' ' SER . 3.2 m -171.64 125.45 0.59 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.461 -0.774 . . . . 0.0 110.054 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.609 ' CE3' ' HB2' ' A' ' 32' ' ' SER . 36.1 p-90 -147.11 -168.77 3.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.375 -0.828 . . . . 0.0 110.075 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.767 ' HB3' HG11 ' B' ' 42' ' ' VAL . 82.2 t60 -162.58 170.77 18.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.146 -0.971 . . . . 0.0 110.079 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.498 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 4.5 m95 -79.91 98.34 7.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.112 -0.992 . . . . 0.0 110.154 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.987 HG21 ' HA ' ' B' ' 42' ' ' VAL . 2.3 m -169.38 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 0.0 110.189 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 39' ' ' GLY . . . . . 0.754 ' N ' HG22 ' B' ' 38' ' ' THR . . . 157.42 -130.67 2.68 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.89 -1.284 . . . . 0.0 109.89 179.839 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 40' ' ' HIS . . . . . 0.501 ' CG ' ' N ' ' B' ' 41' ' ' ASN . 33.6 p-80 -69.44 -39.29 77.88 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.333 -1.098 . . . . 0.0 110.531 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 41' ' ' ASN . . . . . 0.606 ' O ' HG21 ' B' ' 38' ' ' THR . 22.0 t-20 -110.22 97.18 6.71 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.279 -0.888 . . . . 0.0 110.055 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.987 ' HA ' HG21 ' B' ' 38' ' ' THR . 42.3 t -96.41 108.92 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.184 -0.948 . . . . 0.0 110.449 -179.634 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.474 ' HD3' ' OD1' ' B' ' 41' ' ' ASN . 0.2 OUTLIER -155.87 39.57 0.37 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.323 -0.861 . . . . 0.0 110.021 179.903 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 22.0 m170 -111.94 -69.15 0.88 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.25 -0.906 . . . . 0.0 110.121 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' LYS . . . . . 0.617 ' HB2' ' CE1' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -99.13 -156.59 0.55 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.286 -0.884 . . . . 0.0 110.138 179.933 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.44 ' O ' ' O ' ' B' ' 47' ' ' ALA . 2.8 t -97.46 134.83 40.18 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.106 -0.996 . . . . 0.0 110.869 -179.442 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.532 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -41.9 163.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.473 -0.767 . . . . 0.0 110.277 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.648 HG23 ' O ' ' B' ' 7' ' ' LEU . 64.2 mt -142.38 162.43 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.227 -0.921 . . . . 0.0 110.12 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 t -136.49 168.05 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.098 -1.001 . . . . 0.0 110.725 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.566 HG23 ' HD2' ' B' ' 6' ' ' HIS . 78.4 m -145.94 153.87 41.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.439 -0.788 . . . . 0.0 109.677 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.544 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 0.5 OUTLIER -136.52 135.89 38.89 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.08 -1.013 . . . . 0.0 110.295 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.589 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 0.0 OUTLIER -96.59 124.98 40.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.505 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.462 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 40.5 m-85 -108.71 147.46 31.92 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.344 -0.848 . . . . 0.0 110.076 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -95.29 -17.66 21.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.094 -1.004 . . . . 0.0 110.273 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -139.22 127.33 22.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.403 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 4.2 mt-10 -54.37 -42.63 70.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 110.264 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -53.7 -48.45 69.55 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.209 -0.932 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -58.94 -36.04 74.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.098 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.776 ' NH2' HG22 ' B' ' 76' ' ' THR . 1.8 tmt_? -59.2 -45.73 90.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -0.847 . . . . 0.0 110.915 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.02 -37.94 84.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.027 -1.046 . . . . 0.0 110.774 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -65.67 -38.96 90.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.15 -0.968 . . . . 0.0 110.448 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.711 ' O ' HG22 ' B' ' 66' ' ' VAL . 31.4 t80 -56.25 -65.17 0.65 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.227 -0.921 . . . . 0.0 110.987 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.733 ' C ' HD12 ' B' ' 63' ' ' LEU . 4.6 pp -59.59 -11.54 5.0 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.292 -0.88 . . . . 0.0 110.951 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 64' ' ' SER . . . . . 0.526 ' N ' HD12 ' B' ' 63' ' ' LEU . 4.8 t -91.11 -23.48 20.28 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.014 -1.054 . . . . 0.0 110.663 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -95.57 -28.58 14.78 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.093 -1.005 . . . . 0.0 110.769 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.711 HG22 ' O ' ' B' ' 62' ' ' PHE . 3.5 m -109.02 74.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.095 -1.003 . . . . 0.0 110.231 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -50.12 111.67 0.56 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.382 -0.823 . . . . 0.0 110.108 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.496 HG23 ' HB ' ' B' ' 72' ' ' ILE . 0.5 OUTLIER -87.67 139.56 31.41 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.085 -1.01 . . . . 0.0 110.035 -179.638 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.445 ' HD2' HG23 ' B' ' 68' ' ' ILE . 47.3 Cg_endo -56.85 178.92 0.12 Allowed 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 124.156 1.608 . . . . 0.0 110.518 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -86.07 -0.8 56.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 58.8 p -84.41 -30.29 25.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.19 -0.944 . . . . 0.0 109.7 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.616 HG23 ' O ' ' B' ' 8' ' ' LYS . 47.9 mt -94.51 114.68 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.394 -0.816 . . . . 0.0 110.079 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 73' ' ' THR . . . . . 0.54 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.0 m -95.42 146.23 24.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 110.002 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 5' ' ' VAL . 8.4 p -145.22 154.34 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.159 -0.963 . . . . 0.0 110.857 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.43 -179.5 6.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.493 -0.754 . . . . 0.0 109.89 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 76' ' ' THR . . . . . 0.776 HG22 ' NH2' ' B' ' 59' ' ' ARG . 54.2 p -106.73 163.87 12.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.196 -0.94 . . . . 0.0 110.344 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -165.47 -177.52 37.87 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -148.24 144.23 27.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.151 -1.205 . . . . 0.0 110.347 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.507 ' SD ' HG21 ' B' ' 4' ' ' ILE . 96.6 mtp -115.18 172.95 6.76 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.283 -0.885 . . . . 0.0 110.108 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.412 ' O ' HG23 ' B' ' 81' ' ' ILE . 2.2 t -133.21 102.36 5.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 0.0 110.312 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.412 HG23 ' O ' ' B' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mmm . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 121.306 0.574 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.522 ' O ' ' CG ' ' A' ' 79' ' ' MET . 0.3 OUTLIER -103.14 101.31 21.2 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 110.186 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.503 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -56.37 164.42 5.42 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.904 1.476 . . . . 0.0 110.243 -179.846 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' A' ' 77' ' ' GLY . 1.3 pt -144.01 125.39 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.172 -0.955 . . . . 0.0 110.187 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.542 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 5.6 p -94.34 132.56 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.211 -0.931 . . . . 0.0 110.246 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.579 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.1 OUTLIER -105.28 126.23 51.87 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.767 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.894 ' CD1' HG23 ' A' ' 72' ' ' ILE . 13.0 tp -115.01 133.65 55.86 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.16 -0.962 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.521 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.1 tttt -141.15 166.38 24.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.335 -0.853 . . . . 0.0 109.974 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.521 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.32 -171.55 32.22 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.751 -1.339 . . . . 0.0 109.751 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.0 136.08 56.38 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -1.158 . . . . 0.0 110.39 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.537 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.81 -48.41 59.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.303 -0.873 . . . . 0.0 110.652 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.8 -56.17 13.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.082 -1.011 . . . . 0.0 110.487 -179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.4 m -58.19 -26.0 62.26 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.164 -0.96 . . . . 0.0 110.786 -179.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.816 ' HA ' HD12 ' A' ' 17' ' ' LEU . 56.1 mt -71.86 -31.89 66.92 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.117 -0.989 . . . . 0.0 110.379 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -59.69 -42.7 93.53 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.216 -0.928 . . . . 0.0 110.567 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.4 -37.53 74.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.212 -0.93 . . . . 0.0 111.002 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 14' ' ' LEU . 42.8 mt -58.8 -55.44 35.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.071 -1.018 . . . . 0.0 110.594 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttp85 -45.59 -21.55 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.241 -0.912 . . . . 0.0 110.919 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 17' ' ' LEU . 67.0 t80 -64.41 -59.33 4.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.083 -1.011 . . . . 0.0 110.678 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.5 mtt-85 -68.16 -14.72 63.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 0.0 110.417 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.62 -41.05 88.98 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.253 -0.904 . . . . 0.0 110.573 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -63.51 -25.13 68.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.171 -0.955 . . . . 0.0 110.668 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -75.28 -38.66 60.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 110.575 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.877 ' HB3' HD12 ' A' ' 27' ' ' LEU . 23.1 m-70 -94.73 45.25 1.11 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.399 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.604 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 20.0 p -57.32 -16.1 7.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.349 -0.844 . . . . 0.0 110.229 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.573 HG23 ' SG ' ' A' ' 25' ' ' CYS . 65.3 p -96.85 3.62 52.11 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.454 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.877 HD12 ' HB3' ' A' ' 24' ' ' HIS . 8.0 mt -91.75 -26.28 18.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 0.0 110.137 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.604 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 44.0 p90 -122.13 174.22 7.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.158 -0.964 . . . . 0.0 109.936 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.6 m -101.0 -36.36 9.05 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.118 -0.989 . . . . 0.0 111.949 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.493 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -160.51 123.99 3.47 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.855 -1.153 . . . . 0.0 110.941 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.614 ' O ' HG13 ' A' ' 31' ' ' VAL . 8.5 p -89.62 120.46 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.176 -0.952 . . . . 0.0 110.049 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.64 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 4.4 p -84.21 150.18 25.64 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.321 -0.862 . . . . 0.0 110.953 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.533 ' HB2' ' CE1' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -61.39 158.52 14.4 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.523 179.306 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.5 m -67.77 134.58 51.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.021 -1.049 . . . . 0.0 109.962 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.668 ' CD2' ' O ' ' A' ' 35' ' ' TRP . 46.9 p-90 -145.49 120.7 10.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.106 -0.996 . . . . 0.0 109.917 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.693 ' ND1' HG22 ' A' ' 38' ' ' THR . 0.3 OUTLIER -79.02 161.29 26.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.212 -0.93 . . . . 0.0 110.614 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.585 ' CE3' ' HA ' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -78.62 55.5 1.66 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.929 179.761 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.827 HG21 HG21 ' A' ' 42' ' ' VAL . 6.0 t -148.3 -179.21 6.78 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.197 -0.939 . . . . 0.0 110.228 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.463 ' O ' HG23 ' A' ' 38' ' ' THR . . . -71.21 174.55 40.89 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 41.7 t60 -61.19 -63.36 1.32 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.236 -1.155 . . . . 0.0 110.192 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -65.5 95.41 0.21 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.873 . . . . 0.0 110.607 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.827 HG21 HG21 ' A' ' 38' ' ' THR . 12.7 p -150.16 156.57 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.215 -0.928 . . . . 0.0 110.13 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 44' ' ' HIS . 1.2 mtpt -129.34 -26.0 2.61 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.214 -0.929 . . . . 0.0 110.553 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.44 ' C ' ' O ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -41.55 148.62 0.14 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.242 -0.911 . . . . 0.0 110.276 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.424 ' C ' ' OG ' ' A' ' 46' ' ' SER . 5.3 tttm -68.18 114.62 6.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 110.338 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.424 ' OG ' ' C ' ' A' ' 45' ' ' LYS . 1.3 m -162.61 148.94 12.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.314 -0.866 . . . . 0.0 109.85 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -175.87 125.16 0.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.151 -0.968 . . . . 0.0 110.118 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.813 HG23 ' O ' ' A' ' 7' ' ' LEU . 25.9 mt -141.5 140.97 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.162 -0.961 . . . . 0.0 110.599 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.447 HG12 HD11 ' A' ' 51' ' ' LEU . 48.5 t -121.94 117.81 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.386 -0.821 . . . . 0.0 109.933 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.766 ' C ' HD12 ' A' ' 51' ' ' LEU . 39.2 m -94.15 154.63 17.48 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.192 -0.943 . . . . 0.0 110.49 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.766 HD12 ' C ' ' A' ' 50' ' ' THR . 5.6 mp -135.91 134.72 39.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.234 -0.916 . . . . 0.0 109.889 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.527 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.85 127.49 42.88 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.324 -0.86 . . . . 0.0 110.757 -179.44 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.503 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 15.9 m-85 -109.13 147.84 31.82 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.459 -0.775 . . . . 0.0 109.976 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -88.22 -10.09 50.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.23 -0.919 . . . . 0.0 110.765 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.19 132.42 10.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.116 -0.99 . . . . 0.0 110.319 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 30.1 mm-40 -54.47 -38.15 66.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.304 -0.873 . . . . 0.0 110.054 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -53.65 -53.54 50.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.025 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 34.4 tt0 -57.07 -27.23 61.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.421 -0.8 . . . . 0.0 110.256 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.462 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 25.0 ttt-85 -59.62 -49.57 77.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.182 -0.949 . . . . 0.0 110.257 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -61.37 -33.09 73.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.364 -0.835 . . . . 0.0 110.914 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -65.19 -49.59 69.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.988 -1.07 . . . . 0.0 110.158 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.867 ' CE2' HG21 ' A' ' 66' ' ' VAL . 0.6 OUTLIER -55.4 -41.43 72.69 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.214 -0.929 . . . . 0.0 109.639 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.492 HD23 HD11 ' A' ' 68' ' ' ILE . 2.6 mt -59.77 -24.61 64.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.426 -0.796 . . . . 0.0 110.374 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.7 p -91.77 -19.01 23.04 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.165 -0.959 . . . . 0.0 110.32 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.74 -17.26 20.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.21 -0.931 . . . . 0.0 110.141 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.867 HG21 ' CE2' ' A' ' 62' ' ' PHE . 30.9 t -102.17 97.46 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.319 -0.863 . . . . 0.0 110.329 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.524 ' CD ' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -56.62 104.52 0.15 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.224 -0.922 . . . . 0.0 110.15 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.609 HG23 ' HB ' ' A' ' 72' ' ' ILE . 7.0 mt -89.85 136.44 29.23 Favored Pre-proline 0 C--N 1.301 -1.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.278 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.548 ' HG2' HD13 ' A' ' 72' ' ' ILE . 45.8 Cg_endo -76.76 -158.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.034 1.544 . . . . 0.0 110.214 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.525 ' O ' HG23 ' A' ' 71' ' ' THR . 39.0 mttp -100.92 45.38 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.491 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 70' ' ' LYS . 0.7 OUTLIER -154.69 -10.87 0.13 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.063 -1.023 . . . . 0.0 112.1 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.894 HG23 ' CD1' ' A' ' 7' ' ' LEU . 1.2 mp -94.2 113.74 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 120.596 -1.315 . . . . 0.0 109.962 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.5 m -95.59 144.38 26.09 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.104 -0.997 . . . . 0.0 110.449 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.461 HG12 ' N ' ' A' ' 75' ' ' SER . 24.7 t -90.15 167.09 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 111.085 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.579 ' HB2' ' CB ' ' A' ' 6' ' ' HIS . 1.2 m -144.39 164.45 30.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.671 -0.643 . . . . 0.0 110.895 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.7 p -133.93 156.22 48.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.438 -0.788 . . . . 0.0 109.282 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' A' ' 4' ' ' ILE . . . 176.11 138.58 2.9 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -92.57 140.56 29.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.129 -1.218 . . . . 0.0 110.255 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.614 ' CE ' HD12 ' A' ' 81' ' ' ILE . 2.8 ppp? -126.91 168.55 14.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.138 -0.976 . . . . 0.0 110.309 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.485 ' O ' HG13 ' A' ' 81' ' ' ILE . 0.5 OUTLIER -148.86 108.97 4.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.243 -0.91 . . . . 0.0 110.25 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.614 HD12 ' CE ' ' A' ' 79' ' ' MET . 27.7 mt . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.194 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.4 ' HE3' ' HB3' ' B' ' 1' ' ' MET . 3.2 mmm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.278 0.561 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.546 ' O ' ' CG ' ' B' ' 79' ' ' MET . 0.3 OUTLIER -102.84 100.52 16.86 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.216 -0.927 . . . . 0.0 110.285 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.3 Cg_endo -55.5 164.58 4.01 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 O-C-N 123.974 1.513 . . . . 0.0 110.325 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' B' ' 77' ' ' GLY . 1.3 pt -144.29 125.1 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.936 . . . . 0.0 110.227 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.536 ' CG1' ' HB2' ' B' ' 51' ' ' LEU . 5.5 p -94.23 132.41 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.13 -0.981 . . . . 0.0 110.303 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.584 ' CB ' ' HB2' ' B' ' 75' ' ' SER . 0.1 OUTLIER -105.07 126.5 52.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 109.9 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.889 ' CD1' HG23 ' B' ' 72' ' ' ILE . 13.4 tp -115.34 133.57 55.91 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.089 -1.007 . . . . 0.0 110.591 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.532 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 8.7 tttt -141.2 166.47 24.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.326 -0.859 . . . . 0.0 109.885 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.532 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.53 -171.28 32.36 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.96 136.27 56.62 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.36 -1.083 . . . . 0.0 110.354 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.528 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.7 -49.38 57.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.382 -0.823 . . . . 0.0 110.607 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.11 -56.13 12.15 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.704 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 4.2 m -58.0 -26.85 62.91 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.182 -0.949 . . . . 0.0 110.846 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.835 ' HA ' HD12 ' B' ' 17' ' ' LEU . 60.1 mt -70.98 -31.86 68.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.104 -0.998 . . . . 0.0 110.52 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -59.75 -42.66 93.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.625 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 6.0 t -70.17 -37.32 75.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.195 -0.941 . . . . 0.0 110.837 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.835 HD12 ' HA ' ' B' ' 14' ' ' LEU . 48.7 mt -58.8 -55.81 30.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.252 -0.905 . . . . 0.0 110.708 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ttp85 -45.75 -21.16 0.1 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.88 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' B' ' 17' ' ' LEU . 67.2 t80 -64.58 -60.18 3.42 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.025 -1.047 . . . . 0.0 110.527 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 48.2 mtt-85 -67.48 -14.73 63.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.165 -0.96 . . . . 0.0 110.473 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.64 -40.83 88.87 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.193 -0.942 . . . . 0.0 110.585 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 20.4 mmtp -63.37 -25.45 68.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.26 -0.9 . . . . 0.0 110.677 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.18 -39.04 60.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 110.574 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.864 ' HB3' HD12 ' B' ' 27' ' ' LEU . 23.9 m-70 -94.35 45.12 1.12 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.083 -1.011 . . . . 0.0 110.276 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.623 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 20.9 p -57.14 -15.91 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.212 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.575 HG23 ' SG ' ' B' ' 25' ' ' CYS . 80.4 p -96.86 3.09 52.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.325 -0.859 . . . . 0.0 110.446 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.864 HD12 ' HB3' ' B' ' 24' ' ' HIS . 8.2 mt -91.75 -25.64 18.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.158 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.623 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 44.5 p90 -122.5 173.82 7.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.147 -0.971 . . . . 0.0 109.958 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -100.69 -36.13 9.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.986 -1.071 . . . . 0.0 111.742 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.485 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -160.68 123.93 3.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.845 -1.159 . . . . 0.0 111.059 -179.697 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.615 ' O ' HG13 ' B' ' 31' ' ' VAL . 8.7 p -89.47 119.95 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.161 -0.962 . . . . 0.0 110.037 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.644 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 3.9 p -83.92 150.82 25.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.298 -0.876 . . . . 0.0 110.832 -179.385 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 33' ' ' SER . . . . . 0.52 ' HB2' ' CE1' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -61.45 158.81 13.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.027 -1.045 . . . . 0.0 109.734 179.337 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.0 m -68.01 134.76 51.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.028 -1.045 . . . . 0.0 109.899 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.664 ' O ' ' CD2' ' B' ' 35' ' ' TRP . 46.1 p-90 -145.83 120.6 9.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.101 -1.0 . . . . 0.0 109.937 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.649 ' ND1' HG22 ' B' ' 38' ' ' THR . 0.3 OUTLIER -78.94 161.3 26.78 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.235 -0.915 . . . . 0.0 110.593 -179.646 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.588 ' HA ' ' CE3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -78.65 53.48 1.34 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.259 -0.9 . . . . 0.0 110.165 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.874 HG21 HG21 ' B' ' 42' ' ' VAL . 6.6 t -146.53 -179.41 6.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.363 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 39' ' ' GLY . . . . . 0.459 ' O ' HG23 ' B' ' 38' ' ' THR . . . -69.6 175.32 33.93 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -62.32 -63.05 1.35 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.206 -1.173 . . . . 0.0 110.107 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -65.59 96.89 0.28 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.373 -0.829 . . . . 0.0 110.253 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.874 HG21 HG21 ' B' ' 38' ' ' THR . 12.7 p -151.44 155.08 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.353 -0.842 . . . . 0.0 110.071 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.443 ' O ' ' C ' ' B' ' 44' ' ' HIS . 1.3 mtpt -128.09 -26.15 2.91 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.161 -0.962 . . . . 0.0 110.635 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 44' ' ' HIS . . . . . 0.443 ' C ' ' O ' ' B' ' 43' ' ' LYS . 0.1 OUTLIER -41.33 149.16 0.11 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.242 -0.911 . . . . 0.0 110.314 -179.714 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 45' ' ' LYS . . . . . 0.427 ' C ' ' OG ' ' B' ' 46' ' ' SER . 5.6 tttm -68.74 114.71 7.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.891 . . . . 0.0 110.442 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.427 ' OG ' ' C ' ' B' ' 45' ' ' LYS . 1.3 m -162.55 149.47 13.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.083 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' B' ' 46' ' ' SER . . . -176.52 125.36 0.18 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.177 -0.952 . . . . 0.0 110.286 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.831 HG23 ' O ' ' B' ' 7' ' ' LEU . 40.8 mt -141.87 140.99 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.2 -0.937 . . . . 0.0 110.617 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 49' ' ' VAL . . . . . 0.463 HG12 HD11 ' B' ' 51' ' ' LEU . 48.1 t -121.67 117.81 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 0.0 109.943 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.765 ' C ' HD12 ' B' ' 51' ' ' LEU . 34.9 m -93.95 154.32 17.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 110.374 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.765 HD12 ' C ' ' B' ' 50' ' ' THR . 5.7 mp -135.81 134.78 39.27 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 109.804 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.514 ' OG1' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.84 127.59 42.97 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 110.627 -179.542 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.496 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 16.1 m-85 -109.43 148.02 31.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.449 -0.782 . . . . 0.0 109.737 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -88.25 -9.73 51.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.131 -0.981 . . . . 0.0 110.725 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.07 133.01 10.51 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.464 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 28.5 mm-40 -55.31 -38.34 68.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -0.875 . . . . 0.0 109.984 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -53.57 -53.29 53.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.34 -0.85 . . . . 0.0 109.884 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 34.3 tt0 -56.72 -27.99 60.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 110.143 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.464 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 24.0 ttt-85 -59.54 -49.17 78.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.19 -0.944 . . . . 0.0 110.395 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -61.47 -33.02 73.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.242 -0.911 . . . . 0.0 110.899 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 18.7 mt-30 -65.37 -49.85 67.74 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.152 -0.968 . . . . 0.0 110.063 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.881 ' CE2' HG21 ' B' ' 66' ' ' VAL . 0.6 OUTLIER -55.52 -41.11 72.69 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.275 -0.891 . . . . 0.0 109.642 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.497 HD23 ' CD1' ' B' ' 68' ' ' ILE . 2.6 mt -59.75 -25.58 64.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.413 -0.804 . . . . 0.0 110.178 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 26.0 p -90.48 -19.5 23.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.62 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.83 -17.1 20.42 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.881 HG21 ' CE2' ' B' ' 62' ' ' PHE . 34.8 t -102.04 96.94 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.211 -0.931 . . . . 0.0 110.374 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 67' ' ' LYS . . . . . 0.526 ' CD ' ' O ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -56.13 104.32 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 110.254 179.872 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.595 HG23 ' HB ' ' B' ' 72' ' ' ILE . 6.8 mt -89.88 136.88 28.66 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.92 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.553 ' HG2' HD13 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -77.19 -157.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.127 1.593 . . . . 0.0 110.296 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.513 ' O ' HG23 ' B' ' 71' ' ' THR . 39.3 mttp -101.5 45.24 0.98 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 110.368 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 71' ' ' THR . . . . . 0.513 HG23 ' O ' ' B' ' 70' ' ' LYS . 0.7 OUTLIER -154.76 -10.72 0.13 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.094 -1.004 . . . . 0.0 112.04 -179.745 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.889 HG23 ' CD1' ' B' ' 7' ' ' LEU . 1.2 mp -94.38 113.84 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 120.553 -1.342 . . . . 0.0 109.971 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m -95.44 144.24 26.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.037 -1.039 . . . . 0.0 110.351 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.468 HG12 ' N ' ' B' ' 75' ' ' SER . 24.1 t -90.13 167.14 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 111.084 -178.865 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 75' ' ' SER . . . . . 0.584 ' HB2' ' CB ' ' B' ' 6' ' ' HIS . 1.3 m -144.59 163.72 33.06 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.409 0.623 . . . . 0.0 110.955 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.3 p -133.13 156.91 46.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.5 -0.75 . . . . 0.0 109.222 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' B' ' 4' ' ' ILE . . . 175.69 138.72 2.89 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -92.71 140.63 29.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.074 -1.251 . . . . 0.0 110.243 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.586 ' CE ' HD12 ' B' ' 81' ' ' ILE . 2.7 ppp? -126.55 169.38 13.13 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 110.19 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.48 ' O ' HG13 ' B' ' 81' ' ' ILE . 0.5 OUTLIER -149.95 108.77 3.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.216 -0.928 . . . . 0.0 110.127 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.586 HD12 ' CE ' ' B' ' 79' ' ' MET . 27.0 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.686 ' HE2' ' CD2' ' A' ' 78' ' ' PHE . 1.8 mtp . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.116 0.484 . . . . 0.0 110.094 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -98.79 122.34 53.27 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.133 -0.979 . . . . 0.0 110.734 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 46.7 Cg_endo -80.41 164.04 21.65 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 124.023 1.538 . . . . 0.0 109.716 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 4' ' ' ILE . 4.7 pt -143.26 124.0 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.07 -1.018 . . . . 0.0 110.755 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.593 ' O ' HG13 ' A' ' 5' ' ' VAL . 11.2 p -95.14 124.68 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.441 -0.787 . . . . 0.0 110.353 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.495 ' O ' ' HB2' ' A' ' 75' ' ' SER . 0.3 OUTLIER -107.24 127.57 53.65 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.154 -0.966 . . . . 0.0 110.272 179.755 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.802 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.7 OUTLIER -129.29 153.58 47.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.06 -1.025 . . . . 0.0 110.507 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.493 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 1.2 ttpm? -141.85 169.8 16.91 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.179 -0.951 . . . . 0.0 110.2 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.493 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.22 -175.46 31.66 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -65.05 146.47 54.96 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -1.076 . . . . 0.0 110.549 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.959 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.42 -48.64 56.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.343 -0.848 . . . . 0.0 110.421 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.435 ' OD1' ' N ' ' A' ' 12' ' ' ASN . 3.3 m120 -53.93 -48.87 69.78 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.156 -0.965 . . . . 0.0 110.678 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.476 HG21 ' OG1' ' A' ' 71' ' ' THR . 0.2 OUTLIER -58.27 -20.61 43.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.239 -0.913 . . . . 0.0 110.98 -179.604 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.959 HD12 ' HA ' ' A' ' 11' ' ' ALA . 51.5 mt -75.61 -39.41 57.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.059 -1.025 . . . . 0.0 110.607 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -60.29 -26.39 66.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.154 -0.966 . . . . 0.0 110.505 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.52 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 29.1 t -69.94 -54.01 15.27 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.285 -0.885 . . . . 0.0 110.843 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.588 HD11 HG13 ' A' ' 72' ' ' ILE . 42.2 mt -59.19 -53.19 61.13 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.048 -1.033 . . . . 0.0 110.566 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -46.63 -25.63 0.75 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.422 -0.799 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.52 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 39.1 t80 -64.85 -39.95 94.37 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.968 -1.082 . . . . 0.0 110.514 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.26 -23.76 60.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.514 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 10.3 m-30 -66.42 -27.94 68.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.167 -0.958 . . . . 0.0 110.346 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mmtt -63.58 -42.46 98.31 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.238 -0.914 . . . . 0.0 110.151 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 mmtm -75.12 -40.35 59.92 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.323 -0.861 . . . . 0.0 110.353 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.412 ' HB3' HD22 ' A' ' 27' ' ' LEU . 41.5 m-70 -94.91 39.63 1.1 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.228 -0.92 . . . . 0.0 110.446 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 10.1 p -57.5 -14.69 5.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.267 -0.896 . . . . 0.0 110.593 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.8 p -96.77 3.97 52.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.972 . . . . 0.0 110.403 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.412 HD22 ' HB3' ' A' ' 24' ' ' HIS . 3.3 mp -92.28 -22.89 19.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.234 -0.916 . . . . 0.0 110.434 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 37.4 p90 -130.06 -177.1 4.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.191 -0.943 . . . . 0.0 109.799 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.9 m -95.67 -64.23 1.08 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.016 -1.052 . . . . 0.0 110.333 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.52 145.5 18.97 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.785 -1.197 . . . . 0.0 109.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.669 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.4 p -91.77 102.6 13.69 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.634 -0.666 . . . . 0.0 110.418 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.47 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 2.6 p -52.35 154.52 2.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.08 -1.013 . . . . 0.0 109.598 179.608 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 p -60.56 158.77 11.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.146 -0.971 . . . . 0.0 110.07 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -67.54 126.25 28.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.142 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.502 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 32.7 p-90 -146.24 173.27 12.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.987 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.502 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 4.9 t60 -162.72 -178.26 6.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.125 -0.984 . . . . 0.0 110.687 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 48.8 m95 -79.37 92.37 5.18 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.469 -0.769 . . . . 0.0 110.158 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.497 HG21 HG11 ' A' ' 42' ' ' VAL . 72.6 p -127.55 -142.2 0.27 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.291 -0.881 . . . . 0.0 110.399 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -168.46 -52.63 0.03 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.311 -1.516 . . . . 0.0 109.311 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 -159.67 -61.99 0.07 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -1.083 . . . . 0.0 110.028 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -78.21 108.8 11.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.307 -0.87 . . . . 0.0 109.954 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.497 HG11 HG21 ' A' ' 38' ' ' THR . 0.1 OUTLIER -131.51 135.49 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.186 -0.946 . . . . 0.0 109.975 -179.851 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.537 ' HD3' ' CD2' ' A' ' 44' ' ' HIS . 4.4 tttt -150.54 -38.8 0.13 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.248 -0.908 . . . . 0.0 110.199 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.537 ' CD2' ' HD3' ' A' ' 43' ' ' LYS . 0.0 OUTLIER -147.48 94.89 2.44 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.2 -0.937 . . . . 0.0 110.303 179.774 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -138.19 177.76 7.64 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.15 -0.969 . . . . 0.0 110.144 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.563 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.1 OUTLIER -83.31 73.53 10.13 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.191 -0.943 . . . . 0.0 110.311 -179.961 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.403 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -45.7 154.66 0.2 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.462 -0.774 . . . . 0.0 110.52 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.802 HG23 ' O ' ' A' ' 7' ' ' LEU . 58.0 mt -145.92 150.33 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.333 -0.855 . . . . 0.0 110.435 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.1 t -122.71 170.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 109.805 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 60.9 m -145.76 156.58 43.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.065 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 mp -136.24 133.11 36.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.223 -0.923 . . . . 0.0 110.31 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.503 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 18.5 m -96.81 130.57 44.05 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.361 -0.837 . . . . 0.0 110.219 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.542 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 11.7 m-85 -110.43 147.99 32.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.178 -0.951 . . . . 0.0 109.987 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -78.9 -3.42 44.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.145 -0.972 . . . . 0.0 110.669 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.49 139.65 1.67 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -56.63 -31.93 64.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.907 . . . . 0.0 109.785 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -55.05 -59.74 4.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.606 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -57.31 -36.76 71.5 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.913 . . . . 0.0 111.152 -178.657 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 ttp85 -59.26 -40.98 87.74 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.984 -1.072 . . . . 0.0 110.512 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.54 -40.91 96.37 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.273 -0.892 . . . . 0.0 110.745 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -65.66 -40.35 92.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.121 -0.987 . . . . 0.0 110.537 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.625 ' CE2' HG21 ' A' ' 66' ' ' VAL . 9.4 t80 -55.45 -45.5 76.83 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.153 -0.967 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.55 -16.56 25.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.38 -0.825 . . . . 0.0 110.382 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -22.73 19.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.12 -0.987 . . . . 0.0 110.309 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -95.51 -26.52 15.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.038 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.625 HG21 ' CE2' ' A' ' 62' ' ' PHE . 87.0 t -107.09 75.07 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.874 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.78 104.68 0.47 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.197 -0.94 . . . . 0.0 109.886 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.621 HD12 ' H ' ' A' ' 68' ' ' ILE . 0.8 OUTLIER -88.51 134.92 33.26 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.278 -0.889 . . . . 0.0 109.701 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.591 ' HD2' HG22 ' A' ' 68' ' ' ILE . 44.4 Cg_endo -54.77 -160.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.172 1.617 . . . . 0.0 110.561 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 tttm -95.47 2.98 54.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.907 -179.295 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.476 ' OG1' HG21 ' A' ' 13' ' ' THR . 4.5 p -85.24 -28.59 25.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.076 -1.015 . . . . 0.0 110.774 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.588 HG13 HD11 ' A' ' 17' ' ' LEU . 12.8 mm -94.21 124.57 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.49 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 6.4 t -96.34 138.3 34.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.361 -0.837 . . . . 0.0 110.011 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.01 165.81 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.083 -1.011 . . . . 0.0 111.103 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.495 ' HB2' ' O ' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.23 155.43 45.26 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 110.524 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.6 p -133.67 134.15 42.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.288 -0.882 . . . . 0.0 110.339 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.49 -169.38 25.79 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.599 -1.401 . . . . 0.0 109.599 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.686 ' CD2' ' HE2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -148.07 150.86 34.66 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.378 -1.072 . . . . 0.0 110.165 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HE3' ' A' ' 1' ' ' MET . 26.6 mtp -122.72 158.24 30.56 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.621 ' C ' HD12 ' A' ' 81' ' ' ILE . 0.2 OUTLIER -144.42 111.89 6.06 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 110.114 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.621 HD12 ' C ' ' A' ' 80' ' ' SER . 3.1 mp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.144 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.663 ' HE2' ' CD2' ' B' ' 78' ' ' PHE . 1.7 mtp . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.194 0.521 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 17.6 p -98.52 122.55 53.12 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 0.0 110.678 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.538 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 46.4 Cg_endo -80.69 163.88 21.0 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 123.982 1.517 . . . . 0.0 109.949 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.44 ' O ' HG13 ' B' ' 4' ' ' ILE . 4.9 pt -142.94 123.68 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.108 -0.995 . . . . 0.0 110.813 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.593 ' O ' HG13 ' B' ' 5' ' ' VAL . 11.5 p -94.78 124.94 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 110.319 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' B' ' 75' ' ' SER . 0.3 OUTLIER -107.07 127.16 53.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.197 -0.939 . . . . 0.0 110.192 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.814 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.7 OUTLIER -129.11 153.31 47.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.048 -1.032 . . . . 0.0 110.457 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.495 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 1.2 ttpm? -142.05 169.95 16.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.285 -0.885 . . . . 0.0 110.192 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.495 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.04 -175.27 31.6 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.09 146.01 55.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.29 -1.124 . . . . 0.0 110.583 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.94 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.17 -47.05 54.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.389 -0.819 . . . . 0.0 110.631 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' ASN . . . . . 0.448 ' OD1' ' N ' ' B' ' 12' ' ' ASN . 3.1 m120 -56.05 -48.32 76.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.13 -0.981 . . . . 0.0 110.649 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.487 HG21 ' OG1' ' B' ' 71' ' ' THR . 0.2 OUTLIER -58.15 -21.28 46.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.221 -0.924 . . . . 0.0 110.69 -179.563 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' B' ' 11' ' ' ALA . 54.5 mt -74.63 -39.81 61.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.99 -1.069 . . . . 0.0 110.647 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.48 -26.17 66.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.144 -0.973 . . . . 0.0 110.619 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.532 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 29.4 t -69.81 -53.77 16.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 110.768 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.583 HD11 HG13 ' B' ' 72' ' ' ILE . 39.8 mt -59.23 -53.55 56.95 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.16 -0.962 . . . . 0.0 110.616 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 0.3 OUTLIER -46.47 -25.51 0.69 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.315 -0.865 . . . . 0.0 111.154 -179.358 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.532 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 40.1 t80 -64.9 -40.35 94.95 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.004 -1.06 . . . . 0.0 110.458 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.18 -23.53 60.44 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.141 -0.975 . . . . 0.0 110.584 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.535 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 10.2 m-30 -66.37 -28.05 68.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.147 -0.971 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 mmtt -63.62 -42.21 98.21 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 110.185 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -75.18 -40.41 59.44 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 110.313 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -95.05 39.78 1.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.192 -0.943 . . . . 0.0 110.405 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.507 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 9.4 p -57.62 -14.83 5.97 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.335 -0.853 . . . . 0.0 110.361 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 29.9 p -96.65 3.91 52.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.219 -0.925 . . . . 0.0 110.303 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 mp -92.25 -23.17 19.41 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.236 -0.915 . . . . 0.0 110.364 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.507 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 39.9 p90 -129.6 -177.0 4.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.203 -0.936 . . . . 0.0 109.783 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -95.33 -64.55 1.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.065 -1.022 . . . . 0.0 110.294 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.58 145.2 18.67 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 120.905 -1.122 . . . . 0.0 109.004 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.653 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.7 p -91.77 102.66 13.75 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.74 -0.6 . . . . 0.0 110.471 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 2.6 p -51.87 154.2 2.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.053 -1.029 . . . . 0.0 109.835 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 2.9 p -60.76 158.82 12.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.015 -1.053 . . . . 0.0 109.898 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.71 126.63 30.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.491 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 33.4 p-90 -146.45 173.2 12.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.26 -0.9 . . . . 0.0 110.022 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.491 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 5.0 t60 -162.66 -178.45 6.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.149 -0.97 . . . . 0.0 110.655 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.503 ' CH2' ' OG1' ' A' ' 52' ' ' THR . 55.0 m95 -79.33 92.97 5.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.444 -0.785 . . . . 0.0 110.076 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.494 HG21 HG11 ' B' ' 42' ' ' VAL . 70.7 p -127.58 -142.49 0.27 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 110.256 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -168.09 -51.48 0.03 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -161.09 -61.09 0.06 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -1.105 . . . . 0.0 110.019 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -79.0 108.14 12.26 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.388 -0.82 . . . . 0.0 109.991 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.494 HG11 HG21 ' B' ' 38' ' ' THR . 0.1 OUTLIER -130.99 135.17 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.209 -0.932 . . . . 0.0 110.175 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.537 ' HD3' ' CD2' ' B' ' 44' ' ' HIS . 4.4 tttt -150.1 -39.89 0.14 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.29 -0.881 . . . . 0.0 110.134 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 44' ' ' HIS . . . . . 0.537 ' CD2' ' HD3' ' B' ' 43' ' ' LYS . 0.0 OUTLIER -146.27 95.34 2.6 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.154 -0.966 . . . . 0.0 110.495 179.77 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -138.51 177.1 8.14 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.176 -0.952 . . . . 0.0 110.065 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.562 ' O ' HG13 ' B' ' 48' ' ' ILE . 0.1 OUTLIER -82.86 73.06 9.92 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.269 -0.894 . . . . 0.0 110.405 -179.819 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.407 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -45.08 154.9 0.13 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.423 -0.798 . . . . 0.0 110.586 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.814 HG23 ' O ' ' B' ' 7' ' ' LEU . 56.4 mt -145.99 150.05 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.348 -0.845 . . . . 0.0 110.376 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 2.1 t -122.79 170.13 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.216 -0.927 . . . . 0.0 109.857 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 50' ' ' THR . . . . . . . . . . . . . 73.3 m -145.46 156.53 43.8 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.158 -0.964 . . . . 0.0 110.14 -179.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 mp -136.23 133.65 37.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.889 . . . . 0.0 110.197 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 19.8 m -96.97 130.65 44.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.313 -0.867 . . . . 0.0 110.192 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.538 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 16.3 m-85 -110.06 147.53 33.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.176 -0.953 . . . . 0.0 110.03 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -78.9 -2.95 42.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.727 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.52 139.04 1.21 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.151 -0.968 . . . . 0.0 110.162 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -56.22 -32.31 64.31 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.284 -0.885 . . . . 0.0 109.809 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 17.1 t-105 -54.7 -59.81 4.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 110.612 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.16 -36.73 71.11 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 111.065 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 48.5 ttp85 -59.16 -41.12 87.62 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.937 -1.102 . . . . 0.0 110.627 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.28 -41.25 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.117 -0.99 . . . . 0.0 110.672 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 -65.46 -39.78 92.43 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.165 -0.959 . . . . 0.0 110.56 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.607 ' CE2' HG21 ' B' ' 66' ' ' VAL . 10.1 t80 -55.59 -45.96 77.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.141 -0.974 . . . . 0.0 109.624 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.4 mt -59.72 -15.07 17.13 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.453 -0.78 . . . . 0.0 110.459 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -22.95 18.09 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.068 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -95.02 -26.6 16.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.267 -0.896 . . . . 0.0 109.886 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.607 HG21 ' CE2' ' B' ' 62' ' ' PHE . 89.8 t -107.17 75.55 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.229 -0.919 . . . . 0.0 110.106 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 104.79 0.51 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.186 -0.946 . . . . 0.0 109.936 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.6 ' H ' HD12 ' B' ' 68' ' ' ILE . 0.8 OUTLIER -88.62 135.1 32.79 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.287 -0.883 . . . . 0.0 109.834 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.579 ' HD2' HG22 ' B' ' 68' ' ' ILE . 43.7 Cg_endo -54.76 -160.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.052 1.554 . . . . 0.0 110.706 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' B' ' 70' ' ' LYS . 29.7 tttm -94.66 2.6 55.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.193 -0.942 . . . . 0.0 110.837 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 71' ' ' THR . . . . . 0.487 ' OG1' HG21 ' B' ' 13' ' ' THR . 4.6 p -85.32 -28.64 25.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.12 -0.988 . . . . 0.0 110.972 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.583 HG13 HD11 ' B' ' 17' ' ' LEU . 12.8 mm -94.32 124.36 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.143 -0.973 . . . . 0.0 111.035 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 73' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.3 t -96.18 138.54 33.64 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.001 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -89.87 166.25 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.067 -1.021 . . . . 0.0 111.053 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 75' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -142.67 155.29 44.89 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.647 -0.658 . . . . 0.0 110.427 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.2 p -133.3 134.26 43.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.07 -170.14 26.4 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.663 ' CD2' ' HE2' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.86 150.24 33.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.234 -1.156 . . . . 0.0 110.129 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.419 ' O ' ' HB3' ' B' ' 1' ' ' MET . 24.5 mtp -122.18 157.76 30.86 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.901 . . . . 0.0 110.344 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.624 ' C ' HD12 ' B' ' 81' ' ' ILE . 0.2 OUTLIER -144.41 112.21 6.23 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.26 -0.9 . . . . 0.0 109.921 179.812 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.655 ' OXT' HG22 ' B' ' 81' ' ' ILE . 3.0 mp . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.122 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.207 0.527 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.421 ' O ' HG23 ' A' ' 4' ' ' ILE . 23.9 p -125.11 109.85 27.15 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.296 -0.877 . . . . 0.0 110.106 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -50.75 149.48 14.09 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.003 1.528 . . . . 0.0 110.364 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.865 HD11 ' HA3' ' A' ' 77' ' ' GLY . 1.0 OUTLIER -143.49 175.84 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.786 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.734 HG13 HG11 ' A' ' 74' ' ' VAL . 78.4 t -145.68 121.11 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.173 -0.955 . . . . 0.0 110.168 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.47 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.39 125.72 51.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.243 -0.911 . . . . 0.0 110.333 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.579 ' O ' HG23 ' A' ' 48' ' ' ILE . 3.3 mp -117.65 141.38 48.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.275 -0.89 . . . . 0.0 110.072 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.524 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 20.5 tptp -139.09 160.44 39.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.968 . . . . 0.0 110.455 -179.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.524 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 156.75 -156.76 27.43 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . 0.481 ' OD1' ' HB2' ' A' ' 12' ' ' ASN . 6.9 t70 -65.14 124.93 23.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.306 -1.114 . . . . 0.0 110.452 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.929 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.16 -36.09 28.77 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.261 -0.9 . . . . 0.0 110.388 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.481 ' HB2' ' OD1' ' A' ' 10' ' ' ASP . 3.9 m-20 -69.2 -46.83 66.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.162 -0.961 . . . . 0.0 110.682 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.534 ' CG2' HD11 ' A' ' 72' ' ' ILE . 54.9 m -57.69 -24.05 54.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.148 -0.97 . . . . 0.0 110.298 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.968 ' HA ' HD12 ' A' ' 17' ' ' LEU . 51.9 mt -69.06 -32.36 71.76 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.415 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -59.59 -38.24 80.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 110.373 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 5.8 t -70.08 -36.64 75.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.158 -0.964 . . . . 0.0 110.506 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.968 HD12 ' HA ' ' A' ' 14' ' ' LEU . 31.6 mt -58.6 -50.9 72.13 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.239 -0.913 . . . . 0.0 110.308 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.576 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 11.0 ttm180 -46.4 -27.21 1.0 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.147 -0.971 . . . . 0.0 110.548 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.456 ' CD1' ' C ' ' A' ' 19' ' ' TYR . 9.5 t80 -64.93 -42.08 94.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.141 -0.974 . . . . 0.0 110.612 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 74.1 mtt180 -72.13 -22.4 61.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.086 -1.009 . . . . 0.0 110.447 -179.79 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.576 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 12.8 m-30 -66.58 -9.85 39.52 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.131 -0.981 . . . . 0.0 110.275 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -63.59 -50.92 67.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.257 -0.902 . . . . 0.0 110.536 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -75.14 -14.75 60.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.121 -0.987 . . . . 0.0 110.313 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.758 ' CD2' HD12 ' A' ' 27' ' ' LEU . 2.0 m80 -94.92 19.89 9.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.183 -0.948 . . . . 0.0 110.221 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.496 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 24.5 p -56.83 -24.76 53.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 0.0 110.052 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.463 HG22 ' H ' ' A' ' 26' ' ' THR . 3.5 t -97.08 3.48 51.75 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 110.161 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.758 HD12 ' CD2' ' A' ' 24' ' ' HIS . 23.9 mt -92.13 -32.49 15.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.507 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.496 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 50.8 p90 -117.6 167.53 11.24 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.039 -1.038 . . . . 0.0 109.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.8 m -100.26 -31.09 11.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.185 -0.947 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.93 117.03 2.56 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.104 -0.998 . . . . 0.0 110.792 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.498 ' O ' HG13 ' A' ' 31' ' ' VAL . 3.0 p -89.04 114.71 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.211 -0.931 . . . . 0.0 110.146 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.597 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 88.5 p -68.18 143.31 55.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.461 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 2.2 p -61.41 162.06 8.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.284 -0.885 . . . . 0.0 110.128 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.851 ' CG2' ' HB1' ' A' ' 47' ' ' ALA . 91.3 m -67.96 134.57 50.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.224 -0.922 . . . . 0.0 110.098 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.534 ' O ' ' N ' ' A' ' 48' ' ' ILE . 41.9 p-90 -146.52 -179.21 6.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.141 -0.975 . . . . 0.0 109.921 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.693 ' CD2' ' HB2' ' A' ' 46' ' ' SER . 11.0 t-80 -162.52 174.32 12.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.992 . . . . 0.0 110.417 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.607 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 89.0 m95 -78.43 105.39 9.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.87 . . . . 0.0 110.185 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.734 HG23 HG13 ' A' ' 42' ' ' VAL . 46.3 m -138.54 150.86 46.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.41 -0.806 . . . . 0.0 110.109 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.43 ' O ' HG12 ' A' ' 42' ' ' VAL . . . -163.78 163.46 35.81 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.1 m170 54.94 -153.45 0.32 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.276 -1.132 . . . . 0.0 110.234 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -80.83 108.61 14.64 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.253 -0.905 . . . . 0.0 110.243 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.734 HG13 HG23 ' A' ' 38' ' ' THR . 5.0 p -177.02 153.69 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.264 -0.898 . . . . 0.0 109.88 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -103.91 159.62 15.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.083 -1.01 . . . . 0.0 110.65 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.831 ' NE2' ' HB2' ' A' ' 47' ' ' ALA . 4.8 t-80 -50.26 164.69 0.11 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.39 -0.819 . . . . 0.0 110.275 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.491 ' N ' ' CG ' ' A' ' 44' ' ' HIS . 0.3 OUTLIER -155.38 -79.17 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.177 -0.952 . . . . 0.0 110.547 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.693 ' HB2' ' CD2' ' A' ' 36' ' ' HIS . 0.9 OUTLIER -83.78 70.09 10.31 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.206 -0.934 . . . . 0.0 110.454 -179.632 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.851 ' HB1' ' CG2' ' A' ' 34' ' ' THR . . . -46.24 143.01 2.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.335 -0.853 . . . . 0.0 110.509 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.579 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.5 mt -142.93 134.3 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.364 -0.835 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.402 HG12 ' N ' ' A' ' 50' ' ' THR . 62.0 t -106.92 161.2 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.447 ' HB ' ' OG ' ' A' ' 32' ' ' SER . 22.4 m -145.82 160.15 42.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.296 -0.877 . . . . 0.0 109.885 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.2 134.85 38.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.178 -0.951 . . . . 0.0 110.266 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.24 128.35 43.08 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 110.423 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.445 ' OH ' ' CD2' ' A' ' 62' ' ' PHE . 61.5 m-85 -118.42 151.01 38.59 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.308 -0.87 . . . . 0.0 110.228 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -103.72 -16.67 15.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.217 -0.927 . . . . 0.0 110.341 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.3 m -128.61 131.53 48.13 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 0.0 110.125 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -57.44 -50.04 74.31 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.237 -0.915 . . . . 0.0 110.347 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.65 -43.71 69.02 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.187 -0.945 . . . . 0.0 110.429 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -57.79 -44.91 86.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.313 -0.867 . . . . 0.0 110.589 -179.302 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.429 ' HD2' HG23 ' A' ' 5' ' ' VAL . 4.9 ttt-85 -58.79 -40.45 84.06 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.041 -1.037 . . . . 0.0 110.039 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -61.42 -36.18 79.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.478 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 38.4 mt-30 -65.64 -44.85 85.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.297 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.64 ' O ' HG22 ' A' ' 66' ' ' VAL . 4.2 t80 -55.75 -46.16 77.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.279 -0.888 . . . . 0.0 110.598 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.44 -23.0 62.31 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.927 . . . . 0.0 110.747 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 59.9 p -93.01 -19.87 21.15 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.074 -1.017 . . . . 0.0 110.619 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 27.9 mt-30 -95.83 -8.6 33.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.154 -0.966 . . . . 0.0 110.173 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.738 ' O ' HG23 ' A' ' 66' ' ' VAL . 16.9 m -111.82 108.57 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 0.0 110.047 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -65.61 107.79 1.84 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 110.243 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.404 ' HA ' HD13 ' A' ' 68' ' ' ILE . 16.2 mm -88.96 128.36 52.33 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.218 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 1.078 ' CG ' HD12 ' A' ' 72' ' ' ILE . 43.4 Cg_endo -58.83 -155.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.948 1.499 . . . . 0.0 110.366 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.521 ' O ' ' HD3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -111.02 40.76 1.96 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -0.972 . . . . 0.0 110.554 -179.729 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.74 -15.64 0.12 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.266 -0.896 . . . . 0.0 111.663 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 1.078 HD12 ' CG ' ' A' ' 69' ' ' PRO . 19.1 mt -94.95 103.44 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 120.693 -1.255 . . . . 0.0 110.037 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' THR . . . . . 0.429 HG22 ' N ' ' A' ' 74' ' ' VAL . 61.6 m -95.85 163.9 12.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.289 -0.882 . . . . 0.0 109.969 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.734 HG11 HG13 ' A' ' 5' ' ' VAL . 21.3 t -143.11 130.09 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.056 -1.028 . . . . 0.0 111.651 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 177.43 4.9 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.293 0.568 . . . . 0.0 110.089 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.406 ' O ' ' O ' ' B' ' 80' ' ' SER . 0.7 OUTLIER -111.84 152.97 27.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.176 -0.952 . . . . 0.0 110.252 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.865 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -158.87 168.7 35.04 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' B' ' 78' ' ' PHE . 70.9 m-85 -147.71 124.82 11.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.142 -1.211 . . . . 0.0 110.174 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.3 174.24 6.59 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.223 -0.923 . . . . 0.0 110.384 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.543 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -144.21 106.34 4.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.28 -0.888 . . . . 0.0 110.105 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.543 HG23 ' C ' ' A' ' 80' ' ' SER . 10.7 pt . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.266 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.185 0.517 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.436 ' O ' HG23 ' B' ' 4' ' ' ILE . 24.4 p -125.74 108.59 25.65 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.178 -0.951 . . . . 0.0 110.323 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -49.3 150.04 8.33 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.06 1.558 . . . . 0.0 110.533 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.876 HD11 ' HA3' ' B' ' 77' ' ' GLY . 1.0 OUTLIER -143.88 176.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 0.0 110.391 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.722 HG13 HG11 ' B' ' 74' ' ' VAL . 77.6 t -145.89 120.91 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.245 -0.909 . . . . 0.0 110.1 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.466 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.59 125.54 51.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.597 ' O ' HG23 ' B' ' 48' ' ' ILE . 3.1 mp -117.34 141.43 48.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.327 -0.858 . . . . 0.0 110.194 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.519 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 20.8 tptp -139.13 160.02 40.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.139 -0.976 . . . . 0.0 110.45 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.519 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 156.88 -156.6 27.31 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 10' ' ' ASP . . . . . 0.453 ' OD1' ' HB2' ' B' ' 12' ' ' ASN . 5.4 t70 -65.15 125.01 23.66 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.29 -1.124 . . . . 0.0 110.423 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.956 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.14 -36.8 31.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 110.47 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 12' ' ' ASN . . . . . 0.453 ' HB2' ' OD1' ' B' ' 10' ' ' ASP . 3.7 m-20 -68.35 -47.32 67.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.702 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.537 ' CG2' HD11 ' B' ' 72' ' ' ILE . 63.1 m -57.79 -23.04 50.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.151 -0.968 . . . . 0.0 110.247 -179.695 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.956 HD12 ' HA ' ' B' ' 11' ' ' ALA . 53.9 mt -69.65 -32.11 70.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.289 -0.882 . . . . 0.0 110.285 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -59.72 -38.75 82.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.249 -0.907 . . . . 0.0 110.419 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.434 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 6.8 t -70.04 -36.64 75.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.927 . . . . 0.0 110.459 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.952 HD12 ' HA ' ' B' ' 14' ' ' LEU . 30.2 mt -58.59 -50.7 72.86 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.134 -0.978 . . . . 0.0 110.3 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.568 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 10.9 ttm180 -46.5 -27.13 1.01 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.401 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.463 ' CD1' ' C ' ' B' ' 19' ' ' TYR . 9.1 t80 -64.99 -42.35 94.59 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.188 -0.945 . . . . 0.0 110.694 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 74.8 mtt180 -71.58 -22.63 61.71 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.165 -0.959 . . . . 0.0 110.402 -179.742 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.568 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 12.7 m-30 -66.44 -9.9 38.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.142 -0.974 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.67 -50.87 67.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.237 -0.914 . . . . 0.0 110.434 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -75.07 -14.66 60.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.201 -0.937 . . . . 0.0 110.235 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.759 ' CD2' HD12 ' B' ' 27' ' ' LEU . 2.4 m80 -94.92 19.75 9.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.973 . . . . 0.0 110.186 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 25.4 p -57.08 -25.07 58.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.452 HG22 ' H ' ' B' ' 26' ' ' THR . 3.4 t -96.84 3.37 52.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.265 -0.897 . . . . 0.0 110.001 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.759 HD12 ' CD2' ' B' ' 24' ' ' HIS . 23.9 mt -92.03 -32.61 15.13 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.288 -0.883 . . . . 0.0 110.501 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.493 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 50.6 p90 -117.64 167.17 11.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.004 -1.06 . . . . 0.0 110.129 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.9 m -100.07 -31.06 11.61 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 110.665 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 116.88 2.55 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.006 -1.059 . . . . 0.0 110.744 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.519 ' O ' HG13 ' B' ' 31' ' ' VAL . 3.1 p -89.1 112.88 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.182 -0.949 . . . . 0.0 110.073 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.532 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 91.1 p -66.43 142.95 57.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.367 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 1.5 p -61.32 162.11 8.19 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.809 ' CG2' ' HB1' ' B' ' 47' ' ' ALA . 89.6 m -68.0 134.81 51.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 110.207 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.597 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 41.1 p-90 -146.36 -179.15 6.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.913 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.7 ' CD2' ' HB2' ' B' ' 46' ' ' SER . 11.1 t-80 -162.53 174.41 12.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.128 -0.982 . . . . 0.0 110.427 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.614 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 88.1 m95 -78.65 104.94 9.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.336 -0.853 . . . . 0.0 110.294 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.748 HG23 HG13 ' B' ' 42' ' ' VAL . 44.5 m -138.21 152.01 48.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.431 -0.793 . . . . 0.0 109.943 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 39' ' ' GLY . . . . . 0.425 ' O ' ' CG1' ' B' ' 42' ' ' VAL . . . -164.91 163.08 36.17 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 19.6 m170 55.22 -153.35 0.33 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -1.118 . . . . 0.0 110.197 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 41' ' ' ASN . . . . . 0.402 ' O ' ' HB ' ' B' ' 42' ' ' VAL . 6.2 t-20 -80.79 108.44 14.45 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.188 -0.945 . . . . 0.0 110.189 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.748 HG13 HG23 ' B' ' 38' ' ' THR . 5.5 p -176.95 153.86 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.248 -0.908 . . . . 0.0 109.958 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 18.6 mtpt -104.12 159.21 15.87 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.206 -0.934 . . . . 0.0 110.652 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' HIS . . . . . 0.833 ' NE2' ' HB2' ' B' ' 47' ' ' ALA . 5.0 t-80 -50.29 165.06 0.1 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.43 -0.794 . . . . 0.0 110.291 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 45' ' ' LYS . . . . . 0.487 ' N ' ' CG ' ' B' ' 44' ' ' HIS . 0.8 OUTLIER -155.78 -78.37 0.09 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.321 -0.862 . . . . 0.0 110.547 -179.97 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.7 ' HB2' ' CD2' ' B' ' 36' ' ' HIS . 0.9 OUTLIER -84.31 70.26 10.59 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.26 -0.9 . . . . 0.0 110.456 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.833 ' HB2' ' NE2' ' B' ' 44' ' ' HIS . . . -46.4 142.2 3.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.387 -0.821 . . . . 0.0 110.645 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.597 HG23 ' O ' ' B' ' 7' ' ' LEU . 45.4 mt -142.59 134.85 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.289 -0.882 . . . . 0.0 110.025 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.64 161.22 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.157 -0.964 . . . . 0.0 110.522 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.438 ' HB ' ' OG ' ' B' ' 32' ' ' SER . 23.6 m -145.88 160.32 41.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.805 . . . . 0.0 109.908 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.36 134.96 38.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.162 -0.962 . . . . 0.0 110.335 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 127.29 42.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.235 -0.915 . . . . 0.0 110.255 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' B' ' 62' ' ' PHE . 61.0 m-85 -117.11 150.81 38.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.349 -0.844 . . . . 0.0 109.982 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -103.49 -16.72 15.48 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 19.4 m -128.43 132.42 48.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.181 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -58.19 -49.89 75.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.885 . . . . 0.0 110.252 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.76 -43.52 69.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.342 -0.849 . . . . 0.0 110.527 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -57.85 -45.29 86.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.319 -0.863 . . . . 0.0 110.612 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.463 ' HD2' HG23 ' B' ' 5' ' ' VAL . 4.7 ttt-85 -58.83 -40.86 85.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.091 -1.005 . . . . 0.0 110.119 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -61.12 -35.79 77.99 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.862 . . . . 0.0 110.301 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.464 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 38.4 mt-30 -65.61 -45.21 84.0 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.243 -0.91 . . . . 0.0 110.391 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.66 ' O ' HG22 ' B' ' 66' ' ' VAL . 4.4 t80 -55.53 -46.2 77.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.314 -0.866 . . . . 0.0 110.703 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.57 -22.03 61.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.233 -0.917 . . . . 0.0 110.693 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 58.9 p -93.92 -19.82 20.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.247 -0.908 . . . . 0.0 110.574 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 65' ' ' GLN . . . . . 0.464 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 30.0 mt-30 -95.82 -9.58 31.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.21 -0.931 . . . . 0.0 110.066 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.73 HG23 ' O ' ' B' ' 66' ' ' VAL . 16.8 m -110.75 109.02 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.865 . . . . 0.0 110.155 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -66.31 107.96 2.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.347 -0.846 . . . . 0.0 110.266 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.437 ' O ' ' O ' ' B' ' 69' ' ' PRO . 17.1 mm -89.1 127.45 55.45 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.41 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 1.081 ' CG ' HD12 ' B' ' 72' ' ' ILE . 43.5 Cg_endo -57.46 -155.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 124.054 1.555 . . . . 0.0 110.442 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' LYS . . . . . 0.521 ' HD3' ' O ' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -112.15 40.84 2.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.025 -1.047 . . . . 0.0 110.458 -179.775 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.63 -15.7 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.295 -0.878 . . . . 0.0 111.616 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 1.081 HD12 ' CG ' ' B' ' 69' ' ' PRO . 20.7 mt -94.98 102.95 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 120.934 -1.104 . . . . 0.0 109.898 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 73' ' ' THR . . . . . 0.425 HG22 ' N ' ' B' ' 74' ' ' VAL . 66.0 m -95.45 163.71 13.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.883 . . . . 0.0 110.083 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.722 HG11 HG13 ' B' ' 5' ' ' VAL . 21.5 t -142.88 130.64 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.05 -1.031 . . . . 0.0 111.615 -178.593 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 75' ' ' SER . . . . . 0.429 ' HB3' HG22 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -101.97 178.7 4.54 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.144 179.62 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 76' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.7 OUTLIER -113.75 151.07 32.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 179.81 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.876 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -157.23 169.7 34.32 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' A' ' 78' ' ' PHE . 69.4 m-85 -147.85 126.57 12.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -1.153 . . . . 0.0 110.136 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -100.57 172.59 7.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.093 -1.005 . . . . 0.0 110.297 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.54 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.1 OUTLIER -142.48 107.06 4.82 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.897 . . . . 0.0 109.875 179.86 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.54 HG23 ' C ' ' B' ' 80' ' ' SER . 10.5 pt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.284 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.5 ' HB2' ' CE2' ' A' ' 78' ' ' PHE . 23.9 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 53' ' ' TYR . 52.1 m -128.04 133.17 24.84 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.294 -0.879 . . . . 0.0 109.913 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.517 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -81.5 161.7 19.51 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.925 1.487 . . . . 0.0 110.319 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.609 HG22 ' CG2' ' A' ' 52' ' ' THR . 6.5 pt -144.05 163.63 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.093 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.8 t -145.75 129.84 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.2 OUTLIER -105.37 137.0 43.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.267 -0.895 . . . . 0.0 110.374 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.671 HD21 ' HB ' ' A' ' 49' ' ' VAL . 3.4 pp -125.38 142.78 51.31 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.343 -0.848 . . . . 0.0 109.826 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.831 ' O ' HD13 ' A' ' 72' ' ' ILE . 21.6 tptt -136.18 154.82 50.84 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.054 -1.028 . . . . 0.0 110.833 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 161.89 -178.74 37.63 Favored Glycine 0 N--CA 1.486 1.985 0 N-CA-C 108.455 -1.858 . . . . 0.0 108.455 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.56 150.47 48.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.976 -1.308 . . . . 0.0 111.07 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.849 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.83 -52.18 43.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.143 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -48.82 -45.55 40.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.11 -0.994 . . . . 0.0 110.16 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.2 m -58.03 -20.89 42.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.33 -0.856 . . . . 0.0 110.203 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.849 HD12 ' HA ' ' A' ' 11' ' ' ALA . 16.5 mt -83.93 -32.32 25.15 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.235 -0.915 . . . . 0.0 110.302 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -60.91 -37.04 80.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.075 -1.016 . . . . 0.0 110.488 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -47.77 59.27 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.268 -0.895 . . . . 0.0 111.384 -179.054 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.0 mt -58.44 -52.38 65.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.072 -1.017 . . . . 0.0 110.539 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 -45.66 -33.94 3.2 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -64.73 -13.13 53.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.233 -0.917 . . . . 0.0 110.163 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.22 -33.2 10.53 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.244 -0.91 . . . . 0.0 110.241 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.561 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 8.7 m-30 -66.59 -33.63 76.1 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.48 -44.83 93.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 110.383 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -75.03 -32.63 61.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.187 -0.946 . . . . 0.0 110.249 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.606 ' O ' ' N ' ' A' ' 26' ' ' THR . 1.3 m-70 -95.78 34.65 1.48 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.322 -0.861 . . . . 0.0 110.34 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.601 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 13.2 p -59.6 43.53 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.435 -0.791 . . . . 0.0 112.011 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.606 ' N ' ' O ' ' A' ' 24' ' ' HIS . 75.3 p -144.72 33.29 1.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.768 -1.208 . . . . 0.0 109.663 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.405 ' HG ' ' C ' ' A' ' 26' ' ' THR . 78.6 mt -146.31 -5.79 0.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.183 -0.948 . . . . 0.0 111.448 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.601 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 10.5 p90 -126.13 162.38 25.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.686 -1.259 . . . . 0.0 108.912 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.495 ' HB ' ' O ' ' A' ' 52' ' ' THR . 6.6 m -101.81 -38.74 7.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.641 -1.287 . . . . 0.0 111.34 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.01 120.08 2.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.881 -1.137 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.652 ' O ' HG22 ' B' ' 38' ' ' THR . 3.2 p -88.97 105.65 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.281 -0.887 . . . . 0.0 109.893 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.608 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 54.7 p -64.35 152.87 40.14 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.528 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.46 155.56 21.49 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.278 -0.888 . . . . 0.0 110.109 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' THR . . . . . 0.58 ' HA ' HG22 ' A' ' 49' ' ' VAL . 31.9 m -68.05 129.18 39.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.223 -0.923 . . . . 0.0 110.546 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.604 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 50.5 p-90 -147.13 179.92 7.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.207 -0.933 . . . . 0.0 110.125 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.595 ' CG ' ' HA ' ' A' ' 46' ' ' SER . 36.2 t-80 -162.57 173.27 14.19 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.977 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.539 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 98.1 m95 -79.07 126.0 30.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.13 -0.981 . . . . 0.0 109.928 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.416 HG22 ' O ' ' B' ' 31' ' ' VAL . 11.4 t -107.85 152.8 23.91 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -170.24 175.88 44.07 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -63.02 -27.78 69.65 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -1.134 . . . . 0.0 110.237 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -125.44 101.72 7.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.249 -0.907 . . . . 0.0 110.124 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.0 m -115.18 176.67 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.292 -0.88 . . . . 0.0 110.151 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.0 pttt -131.97 -175.33 3.7 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.282 -0.886 . . . . 0.0 110.145 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -51.9 -54.97 23.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.324 -0.86 . . . . 0.0 110.255 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LYS . . . . . 0.481 ' HE2' ' HE2' ' A' ' 8' ' ' LYS . 13.5 mtpt -52.52 114.51 1.4 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.261 -0.899 . . . . 0.0 110.321 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.595 ' HA ' ' CG ' ' A' ' 36' ' ' HIS . 1.8 t -160.98 66.23 0.3 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.192 -0.943 . . . . 0.0 110.288 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -169.36 115.23 0.57 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.276 -0.89 . . . . 0.0 110.189 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.628 HG23 ' O ' ' A' ' 7' ' ' LEU . 68.7 mt -142.8 155.99 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.406 -0.809 . . . . 0.0 109.854 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.671 ' HB ' HD21 ' A' ' 7' ' ' LEU . 87.2 t -136.24 129.79 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.144 -0.972 . . . . 0.0 110.524 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.469 ' OG1' ' NE2' ' A' ' 6' ' ' HIS . 86.5 m -93.94 150.06 20.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.071 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.55 HD12 HD23 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -135.05 121.18 20.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.103 -0.998 . . . . 0.0 110.055 179.993 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.609 ' CG2' HG22 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -99.0 144.26 28.36 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 110.408 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.517 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 26.4 m-85 -124.08 156.73 36.07 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 109.839 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -83.67 -6.03 59.34 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.149 -0.97 . . . . 0.0 110.682 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.1 m -163.98 156.4 17.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.092 -1.005 . . . . 0.0 110.408 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 62.9 mt-10 -68.62 -41.25 79.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.258 -0.901 . . . . 0.0 110.28 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.412 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 6.0 t90 -53.64 -52.75 58.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.179 -0.95 . . . . 0.0 109.982 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.46 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 48.1 tt0 -58.98 -32.86 70.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.384 -0.823 . . . . 0.0 110.253 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 3.6 ttm180 -59.02 -54.52 46.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.302 -0.874 . . . . 0.0 110.621 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -61.04 -25.87 67.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.193 -0.942 . . . . 0.0 110.32 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.46 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 68.4 mt-30 -65.63 -54.36 28.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.159 -0.963 . . . . 0.0 110.308 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.9 ' CE2' HG21 ' A' ' 66' ' ' VAL . 7.2 t80 -55.76 -46.75 77.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.343 -0.848 . . . . 0.0 110.456 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.4 mt -59.14 -20.64 55.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.281 -0.887 . . . . 0.0 110.343 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.44 -22.54 19.56 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.904 . . . . 0.0 110.289 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -96.41 -21.56 17.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.2 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.9 HG21 ' CE2' ' A' ' 62' ' ' PHE . 59.9 t -97.55 105.55 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.47 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' LYS . . . . . 0.422 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.7 OUTLIER -58.26 103.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.899 179.664 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.581 HG23 ' CG2' ' A' ' 72' ' ' ILE . 40.6 mt -88.9 99.51 1.57 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 110.094 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HG2' HG12 ' A' ' 72' ' ' ILE . 46.8 Cg_endo -45.13 159.41 0.15 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.069 1.563 . . . . 0.0 110.36 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -63.82 -13.68 46.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.5 p -84.62 -21.11 30.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.268 -0.895 . . . . 0.0 110.195 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.831 HD13 ' O ' ' A' ' 8' ' ' LYS . 6.8 mm -94.24 113.47 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.0 110.183 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.5 m -94.35 145.06 25.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.252 -0.905 . . . . 0.0 110.174 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.51 171.8 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.204 -0.935 . . . . 0.0 110.921 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.596 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.6 OUTLIER -142.68 154.65 44.52 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.576 -0.703 . . . . 0.0 110.496 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 60.4 p -131.77 134.89 46.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.174 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.34 -170.7 34.2 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' B' ' 78' ' ' PHE . 0.0 OUTLIER -147.71 143.91 27.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.362 -1.081 . . . . 0.0 110.033 -179.934 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.2 mmm -135.89 155.42 50.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.779 -1.201 . . . . 0.0 110.649 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.81 108.56 5.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 0.0 110.065 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.3 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.216 -179.972 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.514 ' HB2' ' CE2' ' B' ' 78' ' ' PHE . 22.5 mtp . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.205 0.526 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.514 HG23 ' O ' ' B' ' 53' ' ' TYR . 58.8 m -127.31 133.84 25.51 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.382 -0.824 . . . . 0.0 110.154 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.51 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -82.19 161.2 17.82 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.918 1.483 . . . . 0.0 110.287 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.617 HG22 ' CG2' ' B' ' 52' ' ' THR . 6.4 pt -143.99 163.36 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.242 -0.911 . . . . 0.0 110.096 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -145.78 130.89 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.237 -0.915 . . . . 0.0 110.267 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.588 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.2 OUTLIER -106.1 138.91 41.45 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.244 -0.91 . . . . 0.0 110.349 -179.943 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.654 HD21 ' HB ' ' B' ' 49' ' ' VAL . 3.5 pp -127.96 142.9 51.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.195 -0.941 . . . . 0.0 110.299 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.859 ' O ' HD13 ' B' ' 72' ' ' ILE . 24.1 tptt -140.21 163.17 33.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.118 -0.989 . . . . 0.0 110.526 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.509 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 166.16 -79.7 0.12 Allowed Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -173.28 150.7 1.92 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.252 -1.146 . . . . 0.0 109.509 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.653 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.39 -57.3 7.17 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 110.645 -179.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -50.65 -48.51 58.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.408 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 69.8 m -58.19 -21.99 49.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.171 -0.956 . . . . 0.0 110.484 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' B' ' 11' ' ' ALA . 16.3 mt -83.34 -32.83 26.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -0.977 . . . . 0.0 110.603 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 ttmt -60.81 -36.98 80.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.016 -1.053 . . . . 0.0 110.635 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -47.5 61.98 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.232 -0.917 . . . . 0.0 111.181 -179.191 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.3 mt -58.54 -52.7 64.53 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.104 -0.998 . . . . 0.0 110.664 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -45.28 -33.69 2.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.232 -0.917 . . . . 0.0 110.135 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -64.82 -13.64 56.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.269 -0.895 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.48 -33.4 10.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.169 -0.957 . . . . 0.0 110.172 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.1 m-30 -66.49 -33.91 76.74 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.23 -0.919 . . . . 0.0 110.355 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.42 -44.7 93.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.343 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 mmtm -74.97 -32.93 61.81 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.184 -0.947 . . . . 0.0 110.26 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.602 ' O ' ' N ' ' B' ' 26' ' ' THR . 1.3 m-70 -95.48 35.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.281 -0.887 . . . . 0.0 110.238 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.604 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.3 p -59.78 43.07 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.467 -0.771 . . . . 0.0 112.139 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.602 ' N ' ' O ' ' B' ' 24' ' ' HIS . 77.8 p -144.69 33.84 1.15 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.729 -1.232 . . . . 0.0 109.846 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.423 ' HG ' ' C ' ' B' ' 26' ' ' THR . 81.5 mt -146.5 -6.04 0.55 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.237 -0.914 . . . . 0.0 111.375 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 10.9 p90 -125.42 162.61 24.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.701 -1.249 . . . . 0.0 108.779 178.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' B' ' 52' ' ' THR . 6.9 m -101.77 -39.01 7.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.642 -1.286 . . . . 0.0 111.187 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.97 120.18 2.97 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.059 -1.025 . . . . 0.0 111.185 -179.523 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.565 ' O ' HG13 ' B' ' 31' ' ' VAL . 3.3 p -89.09 105.26 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.006 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.604 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.3 p -64.39 153.05 39.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.252 -0.905 . . . . 0.0 110.557 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.22 155.98 19.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.272 -0.892 . . . . 0.0 110.42 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 34' ' ' THR . . . . . 0.587 ' HA ' HG22 ' B' ' 49' ' ' VAL . 26.8 m -68.17 128.48 36.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.382 -0.824 . . . . 0.0 110.343 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.608 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 49.7 p-90 -146.94 179.51 7.54 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.594 ' CG ' ' HA ' ' B' ' 46' ' ' SER . 36.4 t-80 -162.28 173.3 14.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.081 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.536 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 98.0 m95 -79.18 125.19 29.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 0.0 110.009 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.652 HG22 ' O ' ' A' ' 31' ' ' VAL . 11.3 t -107.22 152.62 23.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.234 -0.916 . . . . 0.0 110.157 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -169.51 177.15 43.22 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -64.5 -27.22 68.83 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.276 -1.132 . . . . 0.0 110.147 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -125.68 102.07 7.17 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.238 -0.914 . . . . 0.0 110.193 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 20.0 m -115.72 176.42 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 110.121 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 6.2 pttt -131.12 -174.69 3.46 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.248 -0.908 . . . . 0.0 110.21 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -52.24 -54.42 31.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.237 -0.914 . . . . 0.0 110.236 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 45' ' ' LYS . . . . . 0.498 ' HE2' ' HE2' ' B' ' 8' ' ' LYS . 13.1 mtpt -53.26 115.38 1.87 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.265 -0.897 . . . . 0.0 110.252 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.594 ' HA ' ' CG ' ' B' ' 36' ' ' HIS . 1.8 t -161.37 65.87 0.28 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 109.989 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -169.05 115.1 0.59 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.335 -0.853 . . . . 0.0 110.327 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.589 HG23 ' O ' ' B' ' 7' ' ' LEU . 62.8 mt -143.1 156.13 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.32 -0.862 . . . . 0.0 109.987 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 49' ' ' VAL . . . . . 0.654 ' HB ' HD21 ' B' ' 7' ' ' LEU . 76.2 t -136.25 129.84 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 110.537 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.504 ' OG1' ' NE2' ' B' ' 6' ' ' HIS . 87.1 m -94.01 149.78 20.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.367 -0.833 . . . . 0.0 109.873 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.542 HD12 HD23 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -134.69 121.56 20.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.043 -1.036 . . . . 0.0 110.052 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.617 ' CG2' HG22 ' B' ' 4' ' ' ILE . 0.0 OUTLIER -99.22 144.57 28.2 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.313 -0.867 . . . . 0.0 110.607 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.514 ' O ' HG23 ' B' ' 2' ' ' THR . 26.0 m-85 -124.62 157.09 36.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.268 -0.895 . . . . 0.0 109.893 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -84.0 -6.99 59.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.264 -0.898 . . . . 0.0 110.664 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.57 157.81 22.57 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.101 -0.999 . . . . 0.0 110.354 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 56' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 57.9 mt-10 -70.16 -41.11 74.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.234 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 57' ' ' TRP . . . . . 0.409 ' O ' ' HG3' ' B' ' 61' ' ' GLN . 6.0 t90 -53.56 -52.55 59.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.093 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 46.5 tt0 -59.28 -32.55 70.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.855 . . . . 0.0 110.233 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 3.7 ttm180 -59.11 -54.38 47.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.228 -0.92 . . . . 0.0 110.448 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.15 -26.07 67.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.217 -0.927 . . . . 0.0 110.324 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 68.0 mt-30 -65.55 -54.28 30.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.207 -0.933 . . . . 0.0 110.229 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.893 ' CZ ' HG21 ' B' ' 66' ' ' VAL . 7.1 t80 -55.91 -46.69 78.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.318 -0.864 . . . . 0.0 110.518 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.4 mt -59.31 -20.71 56.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.55 -22.3 19.6 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.228 -0.92 . . . . 0.0 110.368 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -96.33 -22.0 17.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.22 -0.925 . . . . 0.0 110.023 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.893 HG21 ' CZ ' ' B' ' 62' ' ' PHE . 60.7 t -97.22 107.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.341 -0.849 . . . . 0.0 110.341 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.28 103.22 0.22 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -0.885 . . . . 0.0 109.855 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.613 HG23 ' CG2' ' B' ' 72' ' ' ILE . 40.1 mt -88.68 98.68 1.17 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.244 -0.91 . . . . 0.0 110.264 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.477 ' HG2' HG12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -43.99 159.45 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.998 1.525 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 20.9 mtmt -63.73 -13.84 47.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.22 -0.925 . . . . 0.0 110.263 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.3 p -84.64 -20.94 30.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 0.0 110.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.859 HD13 ' O ' ' B' ' 8' ' ' LYS . 6.8 mm -93.75 113.22 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 0.0 110.108 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.1 m -94.3 144.96 25.09 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.305 -0.872 . . . . 0.0 110.091 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.54 171.57 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 110.973 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 75' ' ' SER . . . . . 0.588 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -142.93 154.0 43.63 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.613 -0.68 . . . . 0.0 110.516 179.825 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 60.9 p -131.43 135.72 47.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.293 -0.88 . . . . 0.0 110.146 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.47 -170.89 34.54 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' A' ' 78' ' ' PHE . 0.0 OUTLIER -147.69 143.64 27.77 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.253 -1.145 . . . . 0.0 109.964 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.4 mmm -135.7 155.64 50.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.951 -1.093 . . . . 0.0 110.742 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -142.33 109.27 5.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.383 -0.823 . . . . 0.0 109.982 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.216 -179.907 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' A' ' 78' ' ' PHE . 3.5 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.297 0.57 . . . . 0.0 110.307 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.39 108.67 61.95 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.275 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.511 ' O ' ' HA ' ' A' ' 52' ' ' THR . 51.9 Cg_endo -68.68 143.3 55.84 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.019 1.536 . . . . 0.0 110.047 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.42 HG23 ' C ' ' A' ' 3' ' ' PRO . 3.0 pt -144.69 164.75 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.142 -0.974 . . . . 0.0 110.778 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.404 ' CG2' ' HB2' ' A' ' 51' ' ' LEU . 17.1 m -144.54 147.05 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.724 . . . . 0.0 109.497 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -105.71 127.91 53.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.047 -1.033 . . . . 0.0 110.687 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.948 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -116.78 136.0 53.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.536 ' HG3' ' CG1' ' A' ' 48' ' ' ILE . 13.4 ttmt -140.12 164.47 29.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.221 -0.924 . . . . 0.0 110.26 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 152.49 -174.95 31.29 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.89 136.9 57.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.25 -1.147 . . . . 0.0 110.088 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ALA . . . . . 0.778 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.97 -23.31 1.94 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 110.136 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -68.95 -59.84 2.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.22 -0.925 . . . . 0.0 110.304 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.438 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -57.96 -21.67 45.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.324 -0.86 . . . . 0.0 110.21 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.778 HD12 ' HA ' ' A' ' 11' ' ' ALA . 17.9 mt -66.8 -45.57 77.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.303 -0.873 . . . . 0.0 110.443 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -59.93 -31.26 69.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.186 -0.947 . . . . 0.0 110.373 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.513 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.1 t -69.94 -41.75 74.15 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.237 -0.914 . . . . 0.0 110.545 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 13' ' ' THR . 82.3 mt -58.96 -52.48 65.58 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.118 -0.989 . . . . 0.0 110.435 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 24.3 ttt-85 -48.89 -24.35 1.44 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.299 -0.875 . . . . 0.0 110.525 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 9.8 t80 -64.54 -40.67 96.03 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.106 -0.996 . . . . 0.0 110.282 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 mtm-85 -76.17 -15.53 60.04 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.173 -0.955 . . . . 0.0 110.029 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.586 ' CE2' HD21 ' A' ' 51' ' ' LEU . 3.7 m-30 -66.33 -30.9 71.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.251 -0.905 . . . . 0.0 109.836 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -63.31 -33.96 76.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -0.915 . . . . 0.0 109.883 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -74.89 -48.91 22.33 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.85 . . . . 0.0 109.732 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.573 ' HB3' HD22 ' A' ' 27' ' ' LEU . 54.4 m-70 -95.27 28.51 2.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.333 -0.855 . . . . 0.0 109.761 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.714 ' SG ' HG23 ' A' ' 26' ' ' THR . 22.6 p -56.75 -22.02 32.53 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 110.027 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.714 HG23 ' SG ' ' A' ' 25' ' ' CYS . 23.0 p -97.22 10.94 38.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -0.853 . . . . 0.0 109.949 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.573 HD22 ' HB3' ' A' ' 24' ' ' HIS . 0.7 OUTLIER -92.1 -43.37 9.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.0 110.175 179.903 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.632 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 19.8 p90 -96.41 175.72 6.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.1 -1.0 . . . . 0.0 109.965 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.441 ' OG1' ' HB2' ' A' ' 54' ' ' ASP . 88.7 m -101.27 -34.44 9.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.081 -1.012 . . . . 0.0 111.349 -179.285 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.65 118.88 2.52 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.953 -1.092 . . . . 0.0 110.969 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.506 HG13 ' CE1' ' A' ' 28' ' ' TYR . 7.4 m -89.39 100.0 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.973 -1.08 . . . . 0.0 109.623 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.584 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 58.0 p -47.55 144.34 3.17 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.302 -0.874 . . . . 0.0 110.771 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.1 p -61.86 164.92 5.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.228 -0.92 . . . . 0.0 109.948 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.9 m -68.03 120.5 14.36 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.117 -0.99 . . . . 0.0 110.142 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.516 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 32.7 p-90 -146.52 -174.02 4.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 109.64 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.559 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 28.2 t-80 -162.78 171.51 16.64 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.861 -1.149 . . . . 0.0 111.117 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.559 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 22.0 m95 -78.74 93.76 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.472 -0.767 . . . . 0.0 110.151 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.469 ' O ' ' O ' ' B' ' 31' ' ' VAL . 4.0 t -175.1 163.89 3.24 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLY . . . . . 0.448 ' HA2' HG23 ' B' ' 31' ' ' VAL . . . -59.48 -114.92 0.01 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 24.4 p-80 -128.65 -12.32 4.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.196 -1.179 . . . . 0.0 110.616 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.635 ' O ' HG13 ' A' ' 42' ' ' VAL . 3.0 t-20 -141.01 127.41 19.87 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.123 -0.986 . . . . 0.0 110.385 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.635 HG13 ' O ' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -159.32 159.93 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.338 -0.851 . . . . 0.0 110.056 179.83 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -98.48 -27.6 13.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.27 -0.894 . . . . 0.0 110.463 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 73.3 m80 -57.55 167.8 0.96 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.129 -0.982 . . . . 0.0 110.399 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -125.57 122.48 36.63 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.286 -0.884 . . . . 0.0 110.026 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.513 ' O ' HG13 ' A' ' 48' ' ' ILE . 5.5 p -164.94 34.33 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.029 -1.044 . . . . 0.0 110.682 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.07 142.73 3.46 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.284 -0.885 . . . . 0.0 110.51 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.948 HG23 ' O ' ' A' ' 7' ' ' LEU . 63.3 mt -141.89 149.65 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.37 -0.831 . . . . 0.0 110.153 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 40.4 t -120.2 121.32 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.275 -0.891 . . . . 0.0 110.814 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.483 ' HB ' ' OG ' ' A' ' 32' ' ' SER . 33.2 m -93.73 148.95 21.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.329 -0.857 . . . . 0.0 109.131 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.586 HD21 ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -135.04 122.61 22.05 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.921 -1.112 . . . . 0.0 110.789 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 3' ' ' PRO . 26.1 m -98.12 144.26 27.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.547 -0.721 . . . . 0.0 109.416 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.504 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 55.2 m-85 -120.77 155.86 33.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.037 -1.039 . . . . 0.0 110.659 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ASP . . . . . 0.441 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 2.9 t70 -78.16 -9.39 59.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 110.832 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 56' ' ' GLU . 3.0 m -163.3 127.67 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.053 -1.029 . . . . 0.0 110.341 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -45.28 -41.76 8.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.218 -0.926 . . . . 0.0 109.834 179.666 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 57' ' ' TRP . . . . . 0.456 ' CE3' ' HA ' ' A' ' 57' ' ' TRP . 6.1 t-105 -54.05 -51.03 65.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.367 -0.833 . . . . 0.0 110.077 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.427 ' OE1' ' CA ' ' A' ' 58' ' ' GLN . 4.3 tp60 -58.35 -37.78 75.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.266 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.4 ttp85 -59.14 -44.31 92.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.194 -0.941 . . . . 0.0 110.674 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -36.85 80.9 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.158 -0.964 . . . . 0.0 110.16 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -65.68 -41.19 92.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.161 -0.962 . . . . 0.0 110.388 179.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.753 ' CZ ' HG11 ' A' ' 66' ' ' VAL . 23.5 t80 -55.96 -48.14 76.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.335 -0.853 . . . . 0.0 110.13 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 1.053 HD21 HG11 ' A' ' 74' ' ' VAL . 15.4 mt -59.09 -14.88 11.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.33 -0.857 . . . . 0.0 110.448 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.7 p -99.98 -21.46 15.64 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.7 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.539 HE22 HD21 ' A' ' 27' ' ' LEU . 31.6 mt-30 -94.13 -29.03 15.36 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.111 -0.993 . . . . 0.0 110.704 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.753 HG11 ' CZ ' ' A' ' 62' ' ' PHE . 5.5 m -89.79 172.89 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.126 -0.984 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.67 91.73 3.69 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.887 . . . . 0.0 109.459 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.821 HG21 HG21 ' A' ' 74' ' ' VAL . 29.7 mm -88.64 107.48 17.31 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.266 -0.896 . . . . 0.0 110.452 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.966 ' HG2' HD12 ' A' ' 72' ' ' ILE . 43.9 Cg_endo -54.66 -169.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.002 1.528 . . . . 0.0 110.231 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.65 -6.77 24.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.265 -0.897 . . . . 0.0 110.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -84.71 -23.81 29.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.351 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.966 HD12 ' HG2' ' A' ' 69' ' ' PRO . 3.5 mt -94.2 135.42 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.439 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.1 m -95.14 119.84 34.33 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.158 -0.964 . . . . 0.0 110.328 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 1.053 HG11 HD21 ' A' ' 63' ' ' LEU . 88.0 t -102.15 97.72 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.86 . . . . 0.0 109.562 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 59.0 m -102.53 172.12 7.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.568 -1.333 . . . . 0.0 110.698 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.3 p -111.96 177.28 4.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.333 -0.855 . . . . 0.0 109.747 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' GLY . . . . . 0.449 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -179.25 179.06 48.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.479 ' O ' ' O ' ' B' ' 78' ' ' PHE . 25.7 m-85 -147.75 136.87 22.23 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -1.1 . . . . 0.0 110.124 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.5 mtp -119.94 172.61 7.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.116 -0.99 . . . . 0.0 110.408 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.19 100.96 7.49 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.294 -0.879 . . . . 0.0 109.725 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.404 -179.472 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.483 ' HE2' ' HB3' ' B' ' 78' ' ' PHE . 3.2 mtp . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.175 0.512 . . . . 0.0 110.322 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' THR . . . . . 0.411 ' O ' HG23 ' B' ' 4' ' ' ILE . 0.7 OUTLIER -105.98 108.27 61.3 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.35 -0.844 . . . . 0.0 110.366 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.507 ' O ' ' HA ' ' B' ' 52' ' ' THR . 50.7 Cg_endo -67.87 143.26 60.26 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.917 1.483 . . . . 0.0 109.9 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.416 HG23 ' C ' ' B' ' 3' ' ' PRO . 2.8 pt -144.59 164.59 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.076 -1.015 . . . . 0.0 110.649 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.41 ' CG2' ' HB2' ' B' ' 51' ' ' LEU . 16.8 m -144.4 147.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.524 -0.735 . . . . 0.0 109.504 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -105.84 128.2 53.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.995 -1.066 . . . . 0.0 110.53 -179.524 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.926 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.2 OUTLIER -117.24 135.59 53.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.366 -0.834 . . . . 0.0 109.954 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.519 ' HG3' ' CG1' ' B' ' 48' ' ' ILE . 14.4 ttmt -139.78 164.35 30.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.211 -0.931 . . . . 0.0 110.11 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 152.66 -175.7 31.14 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.79 136.39 56.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.322 -1.105 . . . . 0.0 110.127 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' ALA . . . . . 0.783 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.15 -21.75 1.43 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.341 -0.849 . . . . 0.0 110.456 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -70.44 -58.99 3.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.203 -0.936 . . . . 0.0 110.024 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.425 ' O ' ' HG ' ' B' ' 17' ' ' LEU . 0.0 OUTLIER -58.1 -22.27 49.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.352 -0.843 . . . . 0.0 110.238 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.783 HD12 ' HA ' ' B' ' 11' ' ' ALA . 18.8 mt -66.75 -45.49 78.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.568 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.79 -31.13 69.4 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.153 -0.967 . . . . 0.0 110.325 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.513 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.1 t -70.28 -41.74 73.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.399 -0.813 . . . . 0.0 110.682 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' B' ' 13' ' ' THR . 83.2 mt -58.88 -52.69 64.65 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.018 -1.051 . . . . 0.0 110.333 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 18' ' ' ARG . . . . . 0.511 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 23.0 ttt-85 -48.68 -24.16 1.28 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 9.8 t80 -64.68 -40.62 95.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.025 -1.047 . . . . 0.0 110.316 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 69.9 mtm-85 -76.28 -14.82 60.1 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.226 -0.921 . . . . 0.0 110.038 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.601 ' CE2' HD21 ' B' ' 51' ' ' LEU . 3.7 m-30 -66.57 -31.09 71.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.24 -0.913 . . . . 0.0 109.85 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -63.38 -33.89 76.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.373 -0.829 . . . . 0.0 110.169 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -74.85 -49.06 21.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.677 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.577 ' HB3' HD22 ' B' ' 27' ' ' LEU . 20.2 m80 -94.9 28.79 2.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.378 -0.826 . . . . 0.0 109.748 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.731 ' SG ' HG23 ' B' ' 26' ' ' THR . 21.2 p -57.07 -21.8 34.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.759 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.731 HG23 ' SG ' ' B' ' 25' ' ' CYS . 23.6 p -97.27 10.78 38.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 110.073 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.577 HD22 ' HB3' ' B' ' 24' ' ' HIS . 0.7 OUTLIER -92.16 -44.09 8.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.244 -0.91 . . . . 0.0 110.377 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.636 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 20.8 p90 -95.82 175.44 6.51 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.095 -1.003 . . . . 0.0 109.837 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.436 ' OG1' ' HB2' ' B' ' 54' ' ' ASP . 80.7 m -100.95 -33.69 10.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.108 -0.995 . . . . 0.0 111.429 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.75 118.82 2.48 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.049 -1.032 . . . . 0.0 110.972 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.533 HG13 ' CE1' ' B' ' 28' ' ' TYR . 8.1 m -89.43 99.84 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.649 179.074 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.516 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.2 p -47.24 143.18 3.43 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.317 -0.865 . . . . 0.0 110.776 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 33' ' ' SER . . . . . 0.426 ' HA ' ' O ' ' A' ' 39' ' ' GLY . 14.1 p -61.62 164.48 5.94 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.907 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 65.8 m -68.04 121.02 15.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.114 -0.991 . . . . 0.0 110.345 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.584 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 31.2 p-90 -146.74 -173.43 4.21 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.341 -0.85 . . . . 0.0 109.539 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.549 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 74.0 t60 -162.89 171.25 16.91 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.852 -1.155 . . . . 0.0 110.917 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.549 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 26.9 m95 -78.79 93.63 5.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.504 -0.748 . . . . 0.0 110.045 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.412 ' CG2' ' HD2' ' B' ' 36' ' ' HIS . 3.9 t -174.17 167.11 4.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.93 . . . . 0.0 110.438 179.955 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.58 -114.79 0.01 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 19.0 p80 -128.46 -12.47 4.99 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.192 -1.181 . . . . 0.0 110.583 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 41' ' ' ASN . . . . . 0.632 ' O ' HG13 ' B' ' 42' ' ' VAL . 3.0 t-20 -141.12 127.9 20.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.156 -0.965 . . . . 0.0 110.307 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.632 HG13 ' O ' ' B' ' 41' ' ' ASN . 0.1 OUTLIER -159.57 160.85 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.308 -0.87 . . . . 0.0 110.058 179.771 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -99.36 -27.54 13.71 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.223 -0.923 . . . . 0.0 110.483 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 73.7 m80 -57.63 168.26 0.9 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.243 -0.911 . . . . 0.0 110.338 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -126.22 122.91 36.92 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.36 -0.837 . . . . 0.0 110.065 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.54 ' OG ' ' CE1' ' B' ' 36' ' ' HIS . 5.5 p -165.21 34.37 0.06 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.133 -0.979 . . . . 0.0 110.43 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.85 143.02 3.06 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.216 -0.928 . . . . 0.0 110.247 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.926 HG23 ' O ' ' B' ' 7' ' ' LEU . 56.0 mt -141.87 150.29 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.171 -0.955 . . . . 0.0 110.098 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 41.3 t -121.11 121.17 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.233 -0.917 . . . . 0.0 110.731 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.471 ' HB ' ' OG ' ' B' ' 32' ' ' SER . 40.7 m -93.89 148.85 21.75 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.292 -0.88 . . . . 0.0 109.17 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 51' ' ' LEU . . . . . 0.601 HD21 ' CE2' ' B' ' 21' ' ' PHE . 0.4 OUTLIER -134.93 123.17 22.98 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.942 -1.099 . . . . 0.0 111.048 -179.417 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' B' ' 3' ' ' PRO . 24.1 m -98.19 143.81 28.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.515 -0.741 . . . . 0.0 109.61 179.042 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.505 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -120.52 155.31 33.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.066 -1.021 . . . . 0.0 110.552 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 54' ' ' ASP . . . . . 0.436 ' HB2' ' OG1' ' B' ' 29' ' ' THR . 3.0 t70 -77.69 -9.14 58.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.301 -0.874 . . . . 0.0 110.761 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.2 m -163.28 128.06 3.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.128 -0.983 . . . . 0.0 110.493 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -41.54 10.58 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.345 -0.847 . . . . 0.0 109.794 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 57' ' ' TRP . . . . . 0.447 ' HA ' ' CE3' ' B' ' 57' ' ' TRP . 6.0 t-105 -54.26 -51.22 65.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.318 -0.864 . . . . 0.0 110.027 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.44 ' CA ' ' OE1' ' B' ' 58' ' ' GLN . 4.1 tp60 -58.21 -37.25 74.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.16 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 40.0 ttp85 -59.32 -44.84 92.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.091 -1.006 . . . . 0.0 110.609 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -36.87 80.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.157 -0.964 . . . . 0.0 110.286 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 47.8 mt-30 -65.74 -41.08 92.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.292 -0.88 . . . . 0.0 110.29 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.786 ' CZ ' HG11 ' B' ' 66' ' ' VAL . 21.5 t80 -56.11 -48.28 76.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 0.0 110.223 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 1.057 HD21 HG11 ' B' ' 74' ' ' VAL . 15.0 mt -59.04 -14.2 8.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.357 -0.839 . . . . 0.0 110.277 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 17.8 p -100.54 -21.91 15.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.249 -0.907 . . . . 0.0 110.842 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 65' ' ' GLN . . . . . 0.542 HE22 HD21 ' B' ' 27' ' ' LEU . 30.3 mt-30 -94.09 -28.67 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.026 -1.046 . . . . 0.0 110.596 -178.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.786 HG11 ' CZ ' ' B' ' 62' ' ' PHE . 5.5 m -89.57 173.13 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.033 -1.042 . . . . 0.0 110.028 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.14 92.63 3.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.219 -0.926 . . . . 0.0 109.28 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.803 HG21 HG21 ' B' ' 74' ' ' VAL . 30.2 mm -88.99 107.23 16.39 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.366 -0.834 . . . . 0.0 110.438 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.96 ' HG2' HD12 ' B' ' 72' ' ' ILE . 44.8 Cg_endo -54.18 -168.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 124.034 1.544 . . . . 0.0 110.145 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.17 -6.52 24.17 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.138 -0.976 . . . . 0.0 110.411 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 47.8 p -84.84 -23.54 29.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.268 -0.895 . . . . 0.0 110.382 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.96 HD12 ' HG2' ' B' ' 69' ' ' PRO . 3.5 mt -94.15 135.23 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.258 -0.901 . . . . 0.0 110.416 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 39.7 m -95.22 119.87 34.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.174 -0.954 . . . . 0.0 110.217 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 1.057 HG11 HD21 ' B' ' 63' ' ' LEU . 88.6 t -101.81 97.69 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.171 -0.956 . . . . 0.0 109.42 177.599 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 58.2 m -102.47 172.2 7.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.476 -1.39 . . . . 0.0 110.628 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 72.8 p -112.53 176.34 5.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.401 -0.812 . . . . 0.0 109.823 179.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 77' ' ' GLY . . . . . 0.434 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -178.45 179.44 48.64 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.483 ' HB3' ' HE2' ' B' ' 1' ' ' MET . 26.7 m-85 -147.57 137.35 22.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -1.149 . . . . 0.0 110.194 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.6 mtp -120.11 172.64 7.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.129 -0.982 . . . . 0.0 110.338 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.78 100.97 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.305 -0.872 . . . . 0.0 109.73 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.191 -179.542 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.441 ' HE2' ' CD2' ' A' ' 78' ' ' PHE . 69.1 mtp . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.188 0.518 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.5 p -143.97 144.99 28.54 Favored Pre-proline 0 N--CA 1.491 1.577 0 O-C-N 121.253 -0.905 . . . . 0.0 110.272 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.489 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 51.7 Cg_endo -94.16 155.93 2.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.047 1.551 . . . . 0.0 110.062 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ILE . . . . . 0.525 HD13 ' HG3' ' A' ' 79' ' ' MET . 11.4 pt -144.32 166.55 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.136 -0.977 . . . . 0.0 110.563 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.684 HG13 HG21 ' A' ' 74' ' ' VAL . 24.4 t -145.72 124.14 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.378 -0.827 . . . . 0.0 110.017 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.501 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.69 110.57 22.92 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 110.274 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.956 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.7 tp -112.97 150.59 31.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.201 -0.937 . . . . 0.0 110.258 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.747 ' O ' HG23 ' A' ' 72' ' ' ILE . 8.5 ttpp -142.33 170.43 15.72 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.51 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.473 ' O ' HD11 ' A' ' 14' ' ' LEU . . . 151.24 -179.87 27.54 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -65.04 137.12 57.5 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.276 -1.132 . . . . 0.0 110.217 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.32 -31.44 14.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.31 -0.869 . . . . 0.0 110.629 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.7 t-20 -71.14 -55.1 8.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.224 -0.922 . . . . 0.0 110.765 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.1 m -57.85 -20.46 36.56 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.189 -0.945 . . . . 0.0 110.398 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' LEU . . . . . 0.473 HD11 ' O ' ' A' ' 9' ' ' GLY . 20.9 mt -90.34 -25.05 20.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.309 -0.87 . . . . 0.0 110.083 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.4 mmtp -58.88 -42.62 89.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.345 -0.847 . . . . 0.0 110.294 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 19.0 t -69.8 -34.5 73.8 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.425 -0.797 . . . . 0.0 110.435 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 19' ' ' TYR . 5.3 mp -58.85 -53.59 56.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.35 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -44.87 -22.97 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.8 -179.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.455 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 85.7 t80 -64.57 -42.91 95.33 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.101 -0.999 . . . . 0.0 109.877 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -62.6 -27.44 69.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.864 . . . . 0.0 109.969 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.526 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.6 -16.86 64.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.375 -0.828 . . . . 0.0 110.264 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -63.44 -56.11 18.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 109.804 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.457 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.27 -24.76 57.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.399 -0.813 . . . . 0.0 109.834 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.64 ' CA ' HD13 ' A' ' 27' ' ' LEU . 19.5 m170 -94.97 33.21 1.53 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.397 -0.815 . . . . 0.0 110.015 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 23.0 p -57.28 -23.79 50.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.349 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 26' ' ' THR . 2.7 t -97.28 13.52 29.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.194 -0.941 . . . . 0.0 110.687 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' CA ' ' A' ' 24' ' ' HIS . 3.3 mp -92.31 -26.54 18.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -0.983 . . . . 0.0 110.32 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.499 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 34.8 p90 -118.39 167.89 11.14 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -0.988 . . . . 0.0 110.034 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.494 ' N ' ' O ' ' A' ' 52' ' ' THR . 3.6 m -100.01 -34.24 10.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.127 -0.983 . . . . 0.0 110.457 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.569 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.62 117.06 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.926 . . . . 0.0 110.636 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.641 HG13 ' O ' ' B' ' 38' ' ' THR . 14.8 p -90.21 129.74 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.113 -0.992 . . . . 0.0 109.919 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.683 ' O ' HG13 ' A' ' 49' ' ' VAL . 2.0 t -87.4 148.1 25.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.235 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 p -61.18 167.31 3.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.21 -0.931 . . . . 0.0 110.45 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.02 121.07 15.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.281 -0.887 . . . . 0.0 110.538 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.457 ' O ' ' N ' ' A' ' 48' ' ' ILE . 36.8 p-90 -146.93 175.47 10.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.247 -0.908 . . . . 0.0 109.847 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 47' ' ' ALA . 31.6 p80 -162.57 173.39 14.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.07 -1.019 . . . . 0.0 110.702 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.403 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 92.2 m95 -79.66 125.35 29.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.531 -0.73 . . . . 0.0 110.106 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' THR . . . . . 0.515 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.5 t -164.53 164.27 21.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.076 -1.015 . . . . 0.0 110.269 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.34 -66.35 0.09 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -166.2 -48.66 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.257 -1.143 . . . . 0.0 110.163 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -125.35 63.61 1.17 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.92 . . . . 0.0 110.138 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 18.7 m -134.39 154.72 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.342 -0.849 . . . . 0.0 110.079 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 1.0 OUTLIER -53.88 130.4 37.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.206 -0.934 . . . . 0.0 110.166 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -56.67 145.01 30.12 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 110.047 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -108.84 177.98 4.61 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.168 -0.958 . . . . 0.0 110.296 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.511 ' O ' HG13 ' A' ' 48' ' ' ILE . 15.1 m -84.36 116.54 23.08 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.908 . . . . 0.0 110.254 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . -35.9 152.2 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.683 -0.636 . . . . 0.0 110.679 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.956 HG23 ' O ' ' A' ' 7' ' ' LEU . 46.3 mt -141.98 131.42 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.187 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' VAL . . . . . 0.683 HG13 ' O ' ' A' ' 32' ' ' SER . 4.3 t -118.34 125.89 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.243 -0.911 . . . . 0.0 110.189 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.479 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 88.0 m -93.82 157.43 16.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.221 -0.924 . . . . 0.0 110.094 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.6 mt -134.84 128.21 32.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.179 -0.951 . . . . 0.0 110.07 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.569 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 28.4 p -97.12 131.6 43.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.503 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 48.6 m-85 -112.52 150.21 31.6 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.185 -0.947 . . . . 0.0 110.218 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -74.96 -7.65 54.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.221 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.8 p -170.74 157.94 5.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.27 -0.894 . . . . 0.0 110.197 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.54 -37.64 88.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.325 -0.859 . . . . 0.0 110.354 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -54.03 -53.59 50.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.155 -0.965 . . . . 0.0 110.324 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -58.22 -35.46 71.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.299 -0.875 . . . . 0.0 110.44 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ARG . . . . . 0.808 ' NH2' HG23 ' A' ' 76' ' ' THR . 22.4 ttt180 -58.91 -42.55 89.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.047 -1.033 . . . . 0.0 109.963 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -34.8 76.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 39.4 mt-30 -65.62 -45.5 82.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.185 -0.947 . . . . 0.0 110.466 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.678 ' O ' HG13 ' A' ' 66' ' ' VAL . 3.0 t80 -55.96 -49.47 73.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.279 -0.888 . . . . 0.0 110.826 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.572 ' HA ' HG22 ' A' ' 66' ' ' VAL . 97.6 mt -59.28 -46.06 89.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.266 -0.896 . . . . 0.0 110.765 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.1 -20.59 66.54 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.129 -0.982 . . . . 0.0 110.417 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -95.81 -17.39 21.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.91 . . . . 0.0 110.42 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.727 ' O ' HG23 ' A' ' 66' ' ' VAL . 10.9 m -108.66 113.44 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -0.939 . . . . 0.0 110.409 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 115.62 9.9 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 110.064 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.639 HD11 HD11 ' A' ' 7' ' ' LEU . 4.2 tp -88.31 142.62 31.67 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.194 -0.941 . . . . 0.0 110.207 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.601 ' CG ' HD12 ' A' ' 72' ' ' ILE . 47.8 Cg_endo -94.72 162.4 1.81 Allowed 'Trans proline' 0 C--N 1.305 -1.762 0 O-C-N 124.034 1.544 . . . . 0.0 110.464 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -65.35 -16.76 63.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.227 -0.921 . . . . 0.0 110.347 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.3 m -84.68 -31.42 24.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 110.576 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.747 HG23 ' O ' ' A' ' 8' ' ' LYS . 75.6 mt -93.51 148.94 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.096 -1.003 . . . . 0.0 110.641 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 87.7 m -145.52 154.15 41.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.399 -0.813 . . . . 0.0 109.994 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.691 ' HB ' HD12 ' A' ' 7' ' ' LEU . 6.0 p -147.12 162.81 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.108 -0.995 . . . . 0.0 110.647 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' SER . . . . . 0.452 ' N ' HG22 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -139.25 -179.63 5.98 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.439 -0.788 . . . . 0.0 109.997 -179.817 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.808 HG23 ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -108.08 167.72 9.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.159 -0.963 . . . . 0.0 110.354 -179.813 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.79 177.71 43.1 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' PHE . . . . . 0.441 ' CD2' ' HE2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.81 135.86 21.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.37 -1.077 . . . . 0.0 110.114 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.525 ' HG3' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -117.87 153.86 32.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.253 -0.904 . . . . 0.0 110.269 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.8 p -125.35 100.73 6.64 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.285 -0.884 . . . . 0.0 110.176 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.4 tt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.19 -179.966 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.425 ' SD ' ' CE2' ' B' ' 78' ' ' PHE . 71.3 mtp . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.164 0.507 . . . . 0.0 110.081 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 29.2 p -145.34 143.39 20.09 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.17 -0.956 . . . . 0.0 110.343 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.491 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.8 Cg_endo -92.49 155.9 3.0 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.068 1.562 . . . . 0.0 110.214 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.476 HD13 ' HG3' ' B' ' 79' ' ' MET . 11.2 pt -144.23 166.36 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 110.501 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.685 HG13 HG21 ' B' ' 74' ' ' VAL . 24.5 t -145.77 124.07 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.264 -0.898 . . . . 0.0 110.03 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.503 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.0 OUTLIER -105.59 111.11 23.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 110.343 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.952 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.8 tp -113.32 150.13 32.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 110.138 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.738 ' O ' HG23 ' B' ' 72' ' ' ILE . 8.5 ttpp -142.04 169.98 16.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.278 -0.889 . . . . 0.0 110.312 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.472 ' O ' HD11 ' B' ' 14' ' ' LEU . . . 151.96 -179.98 28.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -65.07 137.85 57.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.204 -1.174 . . . . 0.0 110.199 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.43 -31.9 16.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.262 -0.899 . . . . 0.0 110.573 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 10.1 t-20 -70.92 -55.16 9.01 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.273 -0.892 . . . . 0.0 110.846 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.404 ' O ' HD13 ' B' ' 17' ' ' LEU . 5.3 m -57.5 -20.96 34.7 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.179 -0.951 . . . . 0.0 110.391 -179.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 14' ' ' LEU . . . . . 0.472 HD11 ' O ' ' B' ' 9' ' ' GLY . 19.3 mt -90.15 -24.8 20.96 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp -58.91 -42.68 90.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.338 -0.851 . . . . 0.0 110.251 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.466 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.8 t -69.6 -34.98 74.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.417 -0.802 . . . . 0.0 110.36 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.404 HD13 ' O ' ' B' ' 13' ' ' THR . 5.5 mp -58.69 -53.64 56.13 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.343 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.2 ttp85 -44.59 -23.44 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.217 -0.927 . . . . 0.0 110.728 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.466 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 85.8 t80 -64.51 -43.43 94.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.022 -1.049 . . . . 0.0 109.852 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 7.8 mtp85 -61.97 -27.51 68.9 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.391 -0.818 . . . . 0.0 109.987 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.56 -16.99 64.57 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.283 -0.886 . . . . 0.0 110.268 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -63.47 -56.07 19.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.0 109.806 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' LYS . . . . . 0.451 ' N ' ' HD3' ' B' ' 23' ' ' LYS . 0.0 OUTLIER -75.07 -24.91 58.27 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 109.875 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.65 ' CA ' HD13 ' B' ' 27' ' ' LEU . 18.7 m170 -94.93 32.89 1.57 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.413 -0.805 . . . . 0.0 110.106 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.528 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 24.8 p -57.19 -23.6 48.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 0.0 110.395 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 26' ' ' THR . . . . . 0.42 HG22 ' H ' ' B' ' 26' ' ' THR . 2.7 t -97.26 13.42 29.53 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 110.674 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.65 HD13 ' CA ' ' B' ' 24' ' ' HIS . 3.2 mp -92.35 -26.39 18.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.528 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 33.9 p90 -118.36 167.97 11.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.11 -0.994 . . . . 0.0 109.979 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.489 ' N ' ' O ' ' B' ' 52' ' ' THR . 3.7 m -100.29 -34.23 10.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.203 -0.936 . . . . 0.0 110.492 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 30' ' ' ALA . . . . . 0.558 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.52 116.37 2.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.21 -0.931 . . . . 0.0 110.624 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.515 HG13 ' O ' ' A' ' 38' ' ' THR . 14.5 p -90.02 129.89 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 110.005 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.693 ' O ' HG13 ' B' ' 49' ' ' VAL . 2.1 t -87.54 148.41 24.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.41 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.5 p -61.07 166.99 3.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.413 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.99 120.77 14.79 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.287 -0.883 . . . . 0.0 110.423 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.479 ' CE3' ' OG ' ' A' ' 32' ' ' SER . 37.2 p-90 -146.58 175.26 10.72 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.224 -0.922 . . . . 0.0 109.932 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.509 ' HB3' ' HA ' ' B' ' 47' ' ' ALA . 31.4 p80 -162.5 172.97 14.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.092 -1.005 . . . . 0.0 110.724 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.429 ' CH2' HG23 ' A' ' 52' ' ' THR . 92.7 m95 -79.45 124.57 28.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.502 -0.749 . . . . 0.0 110.078 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.641 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.0 t -163.8 164.95 23.44 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.256 -0.902 . . . . 0.0 110.318 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -132.37 -67.38 0.08 OUTLIER Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -164.85 -49.9 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -1.183 . . . . 0.0 110.349 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -123.85 62.23 1.07 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.144 -0.973 . . . . 0.0 110.379 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 21.3 m -133.08 155.18 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.271 -0.893 . . . . 0.0 110.133 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' B' ' 43' ' ' LYS . 1.0 OUTLIER -54.24 131.43 41.51 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.293 -0.879 . . . . 0.0 110.174 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -57.44 144.95 34.59 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.277 -0.889 . . . . 0.0 110.122 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -108.25 178.26 4.55 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.147 -0.97 . . . . 0.0 110.276 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.526 ' O ' HG13 ' B' ' 48' ' ' ILE . 15.0 m -84.75 116.33 23.19 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.888 . . . . 0.0 110.221 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.509 ' HA ' ' HB3' ' B' ' 36' ' ' HIS . . . -35.64 151.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.615 -0.678 . . . . 0.0 110.657 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.952 HG23 ' O ' ' B' ' 7' ' ' LEU . 46.7 mt -142.06 130.31 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.376 -0.828 . . . . 0.0 110.101 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 49' ' ' VAL . . . . . 0.693 HG13 ' O ' ' B' ' 32' ' ' SER . 4.2 t -117.34 125.96 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.884 . . . . 0.0 110.177 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 88.0 m -93.79 157.5 16.11 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 mt -135.09 128.36 32.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 110.286 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.558 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 30.7 p -97.22 132.2 43.21 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.279 -0.888 . . . . 0.0 110.276 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' B' ' 53' ' ' TYR . 49.0 m-85 -113.01 150.36 32.04 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.288 -0.882 . . . . 0.0 110.021 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -75.13 -7.22 53.17 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.895 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 24.9 p -170.72 157.72 5.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.317 -0.864 . . . . 0.0 110.283 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.46 -38.21 90.24 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.265 -0.897 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 8.5 t-105 -53.83 -53.72 48.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.363 -0.836 . . . . 0.0 110.447 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -57.74 -35.43 70.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.473 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 59' ' ' ARG . . . . . 0.804 ' NH2' HG23 ' B' ' 76' ' ' THR . 23.3 ttt180 -58.94 -42.81 90.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.075 -1.016 . . . . 0.0 110.123 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.41 -34.48 75.45 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.322 -0.861 . . . . 0.0 110.333 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -65.77 -45.26 83.16 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.248 -0.908 . . . . 0.0 110.393 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.652 ' O ' HG13 ' B' ' 66' ' ' VAL . 3.2 t80 -56.1 -49.66 73.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.281 -0.887 . . . . 0.0 110.763 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.567 ' HA ' HG22 ' B' ' 66' ' ' VAL . 97.5 mt -59.22 -46.15 89.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.192 -0.942 . . . . 0.0 110.746 -179.355 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.18 -20.7 66.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.204 -0.935 . . . . 0.0 110.436 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -95.7 -17.95 20.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.275 -0.89 . . . . 0.0 110.392 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.718 HG23 ' O ' ' B' ' 66' ' ' VAL . 12.4 m -107.87 114.22 45.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.244 -0.91 . . . . 0.0 110.328 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.41 115.94 11.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.045 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.637 HD11 HD11 ' B' ' 7' ' ' LEU . 4.1 tp -88.07 143.65 33.33 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.198 -0.939 . . . . 0.0 110.264 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.587 ' CG ' HD12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -95.71 161.83 1.45 Allowed 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.059 1.557 . . . . 0.0 110.344 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -65.23 -16.3 63.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.302 -0.874 . . . . 0.0 110.251 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 40.7 m -84.88 -31.35 23.77 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.256 -0.903 . . . . 0.0 110.463 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.738 HG23 ' O ' ' B' ' 8' ' ' LYS . 70.4 mt -93.65 148.83 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.157 -0.964 . . . . 0.0 110.599 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 90.9 m -145.5 154.14 41.89 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.354 -0.842 . . . . 0.0 110.028 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.685 HG21 HG13 ' B' ' 5' ' ' VAL . 6.1 p -147.22 162.81 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.112 -0.992 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 75' ' ' SER . . . . . 0.45 ' N ' HG22 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -139.16 -179.86 6.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.375 -0.828 . . . . 0.0 109.955 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 76' ' ' THR . . . . . 0.804 HG23 ' NH2' ' B' ' 59' ' ' ARG . 0.2 OUTLIER -107.72 167.47 9.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 0.0 110.435 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.24 177.5 42.88 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 78' ' ' PHE . . . . . 0.425 ' CE2' ' SD ' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.73 135.95 21.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.26 -1.141 . . . . 0.0 110.111 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.476 ' HG3' HD13 ' B' ' 4' ' ' ILE . 0.2 OUTLIER -117.94 154.24 32.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 110.281 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.5 p -125.5 100.69 6.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 110.132 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.25 -179.918 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtp . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.279 0.562 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.37 160.46 25.96 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.863 . . . . 0.0 109.989 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PRO . . . . . 0.51 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 51.8 Cg_endo -114.82 159.16 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 123.885 1.466 . . . . 0.0 110.09 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 pt -144.49 164.37 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 110.221 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.443 HG21 ' CE1' ' A' ' 53' ' ' TYR . 97.8 t -145.94 127.64 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . 0.488 ' HB2' ' CE ' ' B' ' 79' ' ' MET . 0.0 OUTLIER -105.63 115.81 30.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.0 110.473 -179.673 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.912 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.6 OUTLIER -118.53 149.76 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.382 -0.824 . . . . 0.0 109.909 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.721 ' O ' HG23 ' A' ' 72' ' ' ILE . 7.4 ttpt -142.72 171.89 13.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.043 -1.036 . . . . 0.0 110.637 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLY . . . . . 0.466 ' HA3' HG12 ' A' ' 72' ' ' ILE . . . 151.51 173.86 21.75 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -64.99 138.23 58.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.16 -1.2 . . . . 0.0 110.056 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.29 -25.56 3.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.25 -0.906 . . . . 0.0 110.691 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' A' ' 15' ' ' LYS . 25.9 t30 -65.55 -61.36 2.14 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.961 . . . . 0.0 110.598 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' THR . . . . . 0.534 ' HB ' HD11 ' A' ' 72' ' ' ILE . 0.2 OUTLIER -57.87 -32.47 67.71 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.101 -0.999 . . . . 0.0 110.338 -179.769 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -67.75 -30.29 69.72 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 0.0 110.01 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 10.0 mmtp -59.99 -45.61 92.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.216 -0.928 . . . . 0.0 110.149 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.531 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 5.7 t -70.08 -36.56 75.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.472 -0.767 . . . . 0.0 110.739 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.9 -56.69 19.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.899 -1.125 . . . . 0.0 110.668 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -47.08 -21.33 0.22 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.676 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.531 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 91.0 t80 -64.27 -27.25 68.91 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.006 -1.059 . . . . 0.0 109.818 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 -79.6 -31.9 41.8 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.264 -0.898 . . . . 0.0 109.882 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 8.8 m-30 -66.33 -14.93 62.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -0.863 . . . . 0.0 110.101 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -63.43 -55.67 22.38 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.494 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 1.8 mptt -75.18 -22.7 57.84 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' HIS . . . . . 0.664 ' HB3' HD22 ' A' ' 27' ' ' LEU . 1.8 m-70 -95.04 38.93 1.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.264 -0.897 . . . . 0.0 110.172 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' CYS . . . . . 0.516 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 25.1 p -57.0 -25.43 58.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.358 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.8 t -97.49 11.34 37.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.268 -0.895 . . . . 0.0 110.76 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.664 HD22 ' HB3' ' A' ' 24' ' ' HIS . 3.0 mp -92.33 -32.41 15.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.083 -1.011 . . . . 0.0 110.355 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' TYR . . . . . 0.516 ' CE1' ' HA ' ' A' ' 25' ' ' CYS . 50.6 p90 -113.38 171.74 7.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.189 -0.945 . . . . 0.0 109.615 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.48 ' HB ' ' O ' ' A' ' 52' ' ' THR . 61.7 m -101.16 -36.22 9.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.056 -1.028 . . . . 0.0 111.064 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.4 122.54 3.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.023 -1.048 . . . . 0.0 110.798 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.683 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.0 p -88.16 108.16 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.162 -0.961 . . . . 0.0 109.891 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . 0.54 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -63.46 146.55 53.4 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.423 -0.798 . . . . 0.0 110.99 -179.403 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . 0.443 ' HB3' ' CG2' ' B' ' 38' ' ' THR . 36.3 p -61.58 163.41 7.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.403 -0.811 . . . . 0.0 110.258 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 115.62 7.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.321 -0.862 . . . . 0.0 110.647 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CB ' ' HB3' ' B' ' 35' ' ' TRP . 16.5 p-90 -146.92 168.66 20.92 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.267 -0.896 . . . . 0.0 110.091 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.546 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 14.2 p-80 -162.47 178.48 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' TRP . . . . . 0.633 ' CH2' HG23 ' B' ' 52' ' ' THR . 80.4 m95 -79.73 125.18 29.33 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.551 -0.718 . . . . 0.0 110.467 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 t -164.8 152.54 11.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.918 . . . . 0.0 110.271 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -112.48 -88.73 1.77 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -157.64 -42.14 0.07 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.211 -1.17 . . . . 0.0 110.127 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.24 56.06 1.12 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.283 -0.886 . . . . 0.0 110.201 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.439 HG23 ' N ' ' A' ' 43' ' ' LYS . 4.1 m -131.17 -157.17 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.265 -0.897 . . . . 0.0 110.179 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 18.2 pttt -95.67 130.85 42.43 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.181 -0.949 . . . . 0.0 110.283 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 29.5 m80 -53.4 145.48 14.35 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.194 -0.941 . . . . 0.0 110.072 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -114.81 146.3 41.19 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.166 -0.959 . . . . 0.0 110.294 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . 0.444 ' O ' ' C ' ' A' ' 47' ' ' ALA . 65.5 m -57.96 116.97 3.83 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.277 -0.889 . . . . 0.0 110.253 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.48 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -38.81 158.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.553 -0.717 . . . . 0.0 110.165 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.912 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.7 mt -140.83 131.34 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.271 -0.893 . . . . 0.0 110.262 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 52.9 t -110.48 117.18 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.308 -0.87 . . . . 0.0 110.691 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.41 ' O ' ' HB3' ' A' ' 32' ' ' SER . 96.2 m -94.14 153.81 17.91 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.21 -0.931 . . . . 0.0 109.626 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.8 mp -136.31 131.2 34.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.931 -1.106 . . . . 0.0 110.497 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.664 HG23 ' CH2' ' B' ' 37' ' ' TRP . 7.6 p -97.34 135.07 39.77 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.394 -0.816 . . . . 0.0 110.042 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 3' ' ' PRO . 88.8 m-85 -111.23 148.75 32.16 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.136 -0.978 . . . . 0.0 110.396 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -81.97 -8.79 59.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.213 -0.93 . . . . 0.0 110.151 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.94 138.45 6.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.334 -0.854 . . . . 0.0 110.196 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -54.79 -39.2 68.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.252 -0.905 . . . . 0.0 110.266 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.77 -51.74 62.45 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 51.3 tt0 -57.12 -40.79 77.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.359 -0.838 . . . . 0.0 110.743 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -59.18 -36.87 76.1 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.036 -1.04 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.08 -44.5 97.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.947 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLN . . . . . 0.507 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 47.8 mt-30 -65.61 -39.0 91.06 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.124 -0.985 . . . . 0.0 110.619 -179.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' PHE . . . . . 0.648 ' O ' HG22 ' A' ' 66' ' ' VAL . 3.0 t80 -54.85 -48.21 73.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.163 -0.961 . . . . 0.0 110.221 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -59.8 -25.95 65.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.191 -0.943 . . . . 0.0 110.163 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.78 -20.41 42.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.299 -0.875 . . . . 0.0 110.628 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 9.1 mm-40 -96.18 -20.58 18.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.159 -0.963 . . . . 0.0 110.418 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' VAL . . . . . 0.648 HG22 ' O ' ' A' ' 62' ' ' PHE . 32.2 m -103.24 118.96 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.247 -0.908 . . . . 0.0 110.413 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -78.31 114.09 16.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.439 HD11 HD11 ' A' ' 7' ' ' LEU . 3.5 tp -88.52 137.42 30.52 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.296 -0.878 . . . . 0.0 110.053 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' A' ' 72' ' ' ILE . 46.7 Cg_endo -98.82 159.95 0.68 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.894 1.47 . . . . 0.0 110.329 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.82 -13.04 8.8 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.238 -0.914 . . . . 0.0 110.157 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 94.5 m -84.28 -38.01 20.99 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.265 -0.897 . . . . 0.0 110.028 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.721 HG23 ' O ' ' A' ' 8' ' ' LYS . 72.4 mt -93.97 149.48 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.314 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 23.4 m -144.9 153.82 41.97 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.235 -0.915 . . . . 0.0 110.029 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.737 ' HB ' HD12 ' A' ' 7' ' ' LEU . 3.3 p -146.54 159.47 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.664 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.54 -179.36 5.86 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.386 -0.821 . . . . 0.0 110.164 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 m -107.93 170.88 7.72 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.177 -0.952 . . . . 0.0 110.719 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.37 -178.57 40.72 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.1 138.0 22.53 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.237 -1.155 . . . . 0.0 110.246 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' MET . . . . . 0.537 ' CE ' ' HB2' ' B' ' 6' ' ' HIS . 0.9 OUTLIER -121.06 170.71 9.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.243 -0.911 . . . . 0.0 110.092 179.847 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 80' ' ' SER . . . . . 0.422 ' O ' ' OG ' ' A' ' 80' ' ' SER . 1.3 p -137.73 103.92 5.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 110.408 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.541 ' O ' ' CG1' ' A' ' 81' ' ' ILE . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.114 -0.946 . . . . 0.0 109.976 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 64.8 mtp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.27 0.557 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.67 160.96 24.27 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 110.063 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 3' ' ' PRO . . . . . 0.515 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 49.9 Cg_endo -115.53 158.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 123.894 1.471 . . . . 0.0 110.04 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 4' ' ' ILE . . . . . 0.404 ' C ' HG23 ' B' ' 5' ' ' VAL . 5.0 pt -144.49 164.01 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 110.367 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 5' ' ' VAL . . . . . 0.469 HG21 ' CE1' ' B' ' 53' ' ' TYR . 98.0 t -145.84 127.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 109.955 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 6' ' ' HIS . . . . . 0.537 ' HB2' ' CE ' ' A' ' 79' ' ' MET . 0.0 OUTLIER -105.47 116.1 31.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.232 -0.917 . . . . 0.0 110.537 -179.642 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 7' ' ' LEU . . . . . 0.893 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.6 OUTLIER -118.56 149.69 40.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.779 179.652 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 8' ' ' LYS . . . . . 0.743 ' O ' HG23 ' B' ' 72' ' ' ILE . 7.3 ttpt -142.43 172.31 12.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.076 -1.015 . . . . 0.0 110.461 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' GLY . . . . . 0.474 ' HA3' HG12 ' B' ' 72' ' ' ILE . . . 150.82 174.1 21.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 36.5 m-20 -65.08 138.55 58.39 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.152 -1.205 . . . . 0.0 110.252 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.47 -25.16 3.68 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' B' ' 15' ' ' LYS . 26.4 t30 -66.54 -61.49 1.96 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 0.0 110.692 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 13' ' ' THR . . . . . 0.522 ' HB ' HD11 ' B' ' 72' ' ' ILE . 0.2 OUTLIER -57.77 -31.72 66.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.053 -1.029 . . . . 0.0 110.388 -179.841 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.24 -30.55 69.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.184 -0.947 . . . . 0.0 110.008 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' B' ' 12' ' ' ASN . 10.2 mmtp -59.65 -45.45 91.97 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.19 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 16' ' ' CYS . . . . . 0.536 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 5.8 t -70.09 -36.25 74.77 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.881 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 17' ' ' LEU . . . . . 0.411 ' HA ' HD12 ' B' ' 17' ' ' LEU . 1.6 mp -58.94 -56.91 16.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.978 -1.076 . . . . 0.0 110.648 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 12.9 ttp85 -47.1 -21.43 0.24 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.263 -0.898 . . . . 0.0 110.655 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 19' ' ' TYR . . . . . 0.536 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 91.5 t80 -64.19 -27.23 68.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.072 -1.017 . . . . 0.0 109.759 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -79.77 -31.66 40.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.354 -0.841 . . . . 0.0 109.836 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' PHE . . . . . 0.554 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.4 m-30 -66.44 -15.01 63.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.289 -0.882 . . . . 0.0 110.068 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -63.36 -55.94 20.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' LYS . . . . . 0.497 ' N ' ' HD3' ' B' ' 23' ' ' LYS . 1.7 mptt -75.05 -22.59 58.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.216 -0.928 . . . . 0.0 110.252 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 24' ' ' HIS . . . . . 0.676 ' HB3' HD22 ' B' ' 27' ' ' LEU . 1.8 m-70 -95.01 38.63 1.12 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 25' ' ' CYS . . . . . 0.555 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 25.1 p -57.13 -25.45 58.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.183 -0.948 . . . . 0.0 110.521 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 14.9 t -97.57 11.37 37.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.191 -0.943 . . . . 0.0 110.615 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 27' ' ' LEU . . . . . 0.676 HD22 ' HB3' ' B' ' 24' ' ' HIS . 3.3 mp -92.3 -32.23 15.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.136 -0.978 . . . . 0.0 110.32 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 28' ' ' TYR . . . . . 0.555 ' CE1' ' HA ' ' B' ' 25' ' ' CYS . 50.2 p90 -113.49 172.06 7.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.236 -0.915 . . . . 0.0 109.665 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 29' ' ' THR . . . . . 0.475 ' HB ' ' O ' ' B' ' 52' ' ' THR . 57.3 m -101.49 -36.37 8.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.035 -1.04 . . . . 0.0 111.065 -179.77 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.39 122.46 3.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.043 -1.035 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 31' ' ' VAL . . . . . 0.678 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.1 p -88.15 109.57 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.276 -0.89 . . . . 0.0 109.816 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 32' ' ' SER . . . . . 0.565 ' HB2' ' CZ3' ' A' ' 37' ' ' TRP . 0.3 OUTLIER -64.88 146.87 54.32 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.427 -0.796 . . . . 0.0 111.173 -179.254 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 78.4 p -61.41 163.06 7.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.373 -0.83 . . . . 0.0 110.081 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.25 115.77 8.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.338 -0.851 . . . . 0.0 110.512 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 35' ' ' TRP . . . . . 0.58 ' HB3' ' CB ' ' A' ' 35' ' ' TRP . 17.7 p-90 -146.99 168.97 20.2 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.126 -0.984 . . . . 0.0 110.13 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 36' ' ' HIS . . . . . 0.518 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 12.7 p-80 -162.6 178.54 8.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 110.734 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 37' ' ' TRP . . . . . 0.664 ' CH2' HG23 ' A' ' 52' ' ' THR . 79.5 m95 -79.72 125.05 29.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.487 -0.758 . . . . 0.0 110.218 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 38' ' ' THR . . . . . 0.443 ' CG2' ' HB3' ' A' ' 33' ' ' SER . 6.8 t -164.42 151.56 11.57 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.313 -0.867 . . . . 0.0 110.254 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -111.88 -89.0 1.84 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 82.4 t60 -157.51 -42.2 0.07 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.329 -1.101 . . . . 0.0 110.207 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.53 55.55 1.16 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.282 -0.886 . . . . 0.0 110.255 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.46 HG23 ' N ' ' B' ' 43' ' ' LYS . 4.3 m -130.32 -155.55 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 110.239 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 43' ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' B' ' 43' ' ' LYS . 18.4 pttt -97.21 131.49 43.89 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.285 -0.884 . . . . 0.0 110.217 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -53.84 145.18 16.64 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.328 -0.857 . . . . 0.0 110.187 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -114.72 145.42 42.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.364 -0.835 . . . . 0.0 110.324 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 46' ' ' SER . . . . . 0.444 ' O ' ' O ' ' B' ' 47' ' ' ALA . 55.8 m -57.32 116.8 3.53 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.253 -0.904 . . . . 0.0 110.212 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 47' ' ' ALA . . . . . 0.487 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -39.02 158.52 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.411 -0.806 . . . . 0.0 110.091 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 48' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 7' ' ' LEU . 44.2 mt -140.74 131.89 29.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.208 -0.932 . . . . 0.0 110.2 -179.134 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 53.7 t -111.11 116.64 53.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.21 -0.931 . . . . 0.0 110.53 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' THR . . . . . 0.414 ' O ' ' HB3' ' B' ' 32' ' ' SER . 98.2 m -93.72 154.03 18.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -0.894 . . . . 0.0 109.535 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 mp -136.17 131.44 34.65 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 110.54 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 52' ' ' THR . . . . . 0.633 HG23 ' CH2' ' A' ' 37' ' ' TRP . 9.1 p -97.62 135.3 39.64 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.273 -0.892 . . . . 0.0 110.028 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 91.1 m-85 -111.46 148.7 32.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.085 -1.009 . . . . 0.0 110.354 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -82.46 -8.65 59.61 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.14 -0.975 . . . . 0.0 110.045 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.16 138.34 7.73 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 110.147 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -55.25 -39.25 69.55 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.339 -0.851 . . . . 0.0 110.169 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.71 -52.06 61.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 110.14 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 58' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 52.1 tt0 -57.07 -41.04 78.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.411 -0.805 . . . . 0.0 110.751 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -59.02 -36.2 74.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.977 -1.077 . . . . 0.0 110.267 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.272 -0.893 . . . . 0.0 110.984 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 61' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 47.5 mt-30 -65.42 -38.55 90.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.599 -179.334 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 62' ' ' PHE . . . . . 0.632 ' O ' HG22 ' B' ' 66' ' ' VAL . 4.0 t80 -54.85 -48.18 73.23 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.64 -25.79 64.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.215 -0.928 . . . . 0.0 110.388 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.22 -20.42 41.11 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.325 -0.859 . . . . 0.0 110.505 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 65' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' B' ' 61' ' ' GLN . 8.9 mm-40 -96.4 -19.31 19.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.286 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 66' ' ' VAL . . . . . 0.632 HG22 ' O ' ' B' ' 62' ' ' PHE . 30.1 m -104.9 118.38 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.2 -0.937 . . . . 0.0 110.232 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -77.94 114.51 16.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.268 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 68' ' ' ILE . . . . . 0.438 HD11 HD11 ' B' ' 7' ' ' LEU . 3.3 tp -88.74 137.26 30.19 Favored Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.228 -0.92 . . . . 0.0 110.151 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 69' ' ' PRO . . . . . 0.459 ' HD2' ' HB ' ' B' ' 72' ' ' ILE . 47.8 Cg_endo -98.43 160.25 0.76 Allowed 'Trans proline' 0 C--N 1.303 -1.832 0 O-C-N 123.911 1.48 . . . . 0.0 110.212 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.03 -12.95 9.31 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.16 -0.962 . . . . 0.0 110.12 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 87.1 m -84.49 -38.24 20.34 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 110.118 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 72' ' ' ILE . . . . . 0.743 HG23 ' O ' ' B' ' 8' ' ' LYS . 78.9 mt -93.81 149.76 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.219 -0.925 . . . . 0.0 110.229 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.4 m -144.87 153.87 42.04 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.33 -0.857 . . . . 0.0 110.147 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 74' ' ' VAL . . . . . 0.718 ' HB ' HD12 ' B' ' 7' ' ' LEU . 3.3 p -146.4 159.66 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.179 -0.95 . . . . 0.0 110.642 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 -179.55 6.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.418 -0.801 . . . . 0.0 110.04 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.5 m -107.8 170.93 7.69 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.081 -1.012 . . . . 0.0 110.715 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.5 -178.91 41.02 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -147.79 138.18 23.02 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -1.137 . . . . 0.0 110.34 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 79' ' ' MET . . . . . 0.488 ' CE ' ' HB2' ' A' ' 6' ' ' HIS . 0.5 OUTLIER -121.4 170.46 9.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.379 -0.825 . . . . 0.0 110.053 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 80' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' B' ' 80' ' ' SER . 1.3 p -137.64 104.24 5.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.17 -0.956 . . . . 0.0 110.341 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 81' ' ' ILE . . . . . 0.55 ' CG1' ' O ' ' B' ' 81' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.126 -0.984 . . . . 0.0 109.965 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.251 0.548 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.44 122.39 61.24 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.5 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -68.96 146.52 65.44 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.063 1.56 . . . . 0.0 110.197 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.422 ' CG1' ' O ' ' A' ' 4' ' ' ILE . 1.7 pp -143.98 117.38 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.168 -0.957 . . . . 0.0 110.364 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -94.13 153.38 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 109.999 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.585 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -134.96 117.59 15.96 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.0 109.85 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.65 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.0 OUTLIER -113.66 148.65 35.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.311 -0.868 . . . . 0.0 110.199 -179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.529 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 16.6 tttm -142.72 168.1 20.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 110.225 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.529 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 151.11 -156.38 26.64 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.14 127.57 32.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.238 -1.154 . . . . 0.0 110.342 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.19 -27.03 5.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.099 179.794 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -77.75 -45.67 23.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.279 -0.888 . . . . 0.0 110.29 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 28.2 m -57.89 -21.76 44.88 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.163 -0.961 . . . . 0.0 110.086 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.987 ' HA ' HD12 ' A' ' 17' ' ' LEU . 30.6 mt -76.62 -29.69 56.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.872 . . . . 0.0 110.343 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -60.18 -39.46 86.54 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.229 -0.919 . . . . 0.0 110.59 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -69.91 -40.31 75.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.249 -0.907 . . . . 0.0 110.7 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.987 HD12 ' HA ' ' A' ' 14' ' ' LEU . 14.5 mt -58.51 -49.55 76.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.143 -0.973 . . . . 0.0 110.334 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.604 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 46.6 ttt-85 -45.04 -37.86 4.45 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.184 -0.948 . . . . 0.0 110.796 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.434 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 87.5 t80 -64.56 -41.77 96.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.103 -0.998 . . . . 0.0 110.344 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -57.67 -36.5 72.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.0 109.871 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 5.8 m-30 -66.79 -18.12 65.22 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.093 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 28.2 mmtt -63.31 -48.24 78.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.954 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.5 mmtt -74.83 -23.88 58.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.826 ' HB3' HD12 ' A' ' 27' ' ' LEU . 36.7 m170 -95.23 33.92 1.49 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.967 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.563 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 21.2 p -56.75 -24.63 51.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.257 -0.902 . . . . 0.0 110.07 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.684 ' O ' HG23 ' A' ' 26' ' ' THR . 14.1 t -96.9 54.09 1.26 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 109.771 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.826 HD12 ' HB3' ' A' ' 24' ' ' HIS . 12.4 mt -147.78 -32.02 0.28 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -0.851 . . . . 0.0 110.755 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.563 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 9.2 p90 -108.76 167.51 10.01 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.928 -1.108 . . . . 0.0 110.012 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 m -100.66 -36.56 9.09 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.091 -1.006 . . . . 0.0 110.88 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.1 118.85 2.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.08 -1.013 . . . . 0.0 110.728 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.406 ' O ' HG13 ' A' ' 31' ' ' VAL . 9.8 p -89.94 136.06 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.266 -0.896 . . . . 0.0 109.935 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.599 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 28.4 p -96.36 149.83 21.26 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.071 -1.018 . . . . 0.0 110.303 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.31 162.02 8.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.22 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -68.0 127.88 34.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.328 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.602 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 40.9 p-90 -146.14 179.95 7.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.198 -0.939 . . . . 0.0 109.798 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.579 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 26.7 t-80 -162.71 173.82 13.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.863 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.579 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 55.9 m95 -78.6 93.35 4.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.401 -0.812 . . . . 0.0 109.834 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.6 t . . . . . 0 N--CA 1.49 1.559 0 O-C-N 121.312 -0.868 . . . . 0.0 110.42 -179.687 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.465 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.676 0 CA-C-O 121.382 0.611 . . . . 0.0 110.559 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.65 HG23 ' O ' ' A' ' 7' ' ' LEU . 40.6 mt -142.49 146.86 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.892 . . . . 0.0 110.115 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.21 178.18 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.185 -0.947 . . . . 0.0 110.25 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.543 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 53.9 m -145.91 151.18 37.43 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.267 -0.896 . . . . 0.0 110.159 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.72 128.91 31.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -0.998 . . . . 0.0 110.091 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -97.91 134.51 40.94 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.301 -0.874 . . . . 0.0 110.642 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.5 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 54.8 m-85 -112.72 151.51 30.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.298 -0.876 . . . . 0.0 110.053 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -76.7 -8.52 57.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 110.622 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.8 p -169.55 160.94 9.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.05 -1.031 . . . . 0.0 110.561 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.2 -41.94 80.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.203 -0.936 . . . . 0.0 109.932 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.48 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 51.7 t-105 -53.51 -52.39 59.77 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 61.7 tt0 -58.74 -30.56 67.59 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.188 -0.945 . . . . 0.0 109.685 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.1 -48.97 79.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.392 -0.817 . . . . 0.0 110.557 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.537 ' OD1' ' N ' ' A' ' 61' ' ' GLN . 2.5 p30 -61.17 -26.54 67.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.087 -1.008 . . . . 0.0 110.315 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.537 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 67.1 mt-30 -65.95 -52.03 53.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.151 -0.968 . . . . 0.0 109.97 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.652 ' O ' HG22 ' A' ' 66' ' ' VAL . 5.7 t80 -55.53 -46.32 77.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 109.718 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.3 mt -59.75 -21.87 61.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.33 -0.856 . . . . 0.0 110.198 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.91 -17.56 29.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 110.076 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -94.65 -14.74 24.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.312 -0.867 . . . . 0.0 110.351 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 62' ' ' PHE . 20.1 m -130.37 134.81 61.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -0.908 . . . . 0.0 110.137 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.5 tptp -86.52 120.05 27.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.205 -0.934 . . . . 0.0 110.322 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.635 HD11 HG23 ' A' ' 66' ' ' VAL . 4.8 mm -88.96 103.6 5.94 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.967 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.73 ' CG ' HD12 ' A' ' 72' ' ' ILE . 46.0 Cg_endo -39.9 154.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.094 1.576 . . . . 0.0 110.418 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 70' ' ' LYS . 13.6 mtpp -70.35 -14.86 62.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 0.0 110.459 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -84.66 -19.32 33.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.361 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.73 HD12 ' CG ' ' A' ' 69' ' ' PRO . 23.8 mt -93.81 123.59 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.6 m -94.7 136.6 34.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.458 -0.776 . . . . 0.0 110.416 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.588 HG12 ' N ' ' A' ' 75' ' ' SER . 92.9 t -90.73 171.99 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.565 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.588 ' N ' HG12 ' A' ' 74' ' ' VAL . 0.4 OUTLIER -142.45 152.82 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.387 -0.821 . . . . 0.0 110.661 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' B' ' 80' ' ' SER . 63.5 p -132.97 135.4 45.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.273 -0.892 . . . . 0.0 110.15 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.502 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -174.39 -173.63 40.53 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.502 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 50.2 m-85 -147.65 151.56 36.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.167 -1.196 . . . . 0.0 110.399 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.408 ' CE ' ' CE ' ' B' ' 79' ' ' MET . 25.5 mtt -119.78 174.84 6.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.182 -0.949 . . . . 0.0 110.287 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.464 ' C ' HG13 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -140.69 108.72 5.73 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.324 -0.86 . . . . 0.0 109.836 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.464 HG13 ' C ' ' A' ' 80' ' ' SER . 23.3 mt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.23 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mtm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.226 0.536 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.5 122.17 61.64 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.161 -0.962 . . . . 0.0 110.44 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.494 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.5 Cg_endo -68.79 146.86 67.62 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.978 1.515 . . . . 0.0 110.071 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.41 ' CG1' ' O ' ' B' ' 4' ' ' ILE . 1.7 pp -144.12 117.22 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.118 -0.989 . . . . 0.0 110.297 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 53.6 t -94.06 152.63 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.268 -0.895 . . . . 0.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.589 ' CB ' ' HB2' ' B' ' 75' ' ' SER . 0.0 OUTLIER -134.45 117.75 16.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.938 179.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.654 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.0 OUTLIER -113.86 148.81 36.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.284 -179.791 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.513 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 16.5 tttm -142.59 168.34 19.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.513 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 151.12 -156.76 26.84 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . 0.402 ' HB2' ' OG1' ' B' ' 13' ' ' THR . 53.5 m-20 -64.98 127.31 31.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -1.188 . . . . 0.0 110.293 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.09 -26.86 4.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.299 -0.876 . . . . 0.0 110.088 179.798 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -77.6 -45.92 23.74 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.19 -0.944 . . . . 0.0 110.219 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.402 ' OG1' ' HB2' ' B' ' 10' ' ' ASP . 28.1 m -57.96 -21.13 42.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.26 -0.9 . . . . 0.0 110.089 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 1.007 ' HA ' HD12 ' B' ' 17' ' ' LEU . 31.7 mt -77.24 -29.79 54.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.247 -0.908 . . . . 0.0 110.246 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -60.13 -38.84 84.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.879 . . . . 0.0 110.582 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.7 t -70.02 -40.19 75.35 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.192 -0.943 . . . . 0.0 110.8 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 1.007 HD12 ' HA ' ' B' ' 14' ' ' LEU . 14.0 mt -58.86 -50.13 75.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.128 -0.982 . . . . 0.0 110.349 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.594 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 46.5 ttt-85 -44.8 -37.26 3.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.924 . . . . 0.0 110.767 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 87.7 t80 -64.97 -41.56 95.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.991 -1.068 . . . . 0.0 110.239 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 mtt180 -58.21 -36.6 73.37 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.212 -0.93 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.594 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 5.8 m-30 -66.54 -17.8 65.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.1 mmtt -63.39 -48.54 77.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.203 -0.936 . . . . 0.0 110.035 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -74.66 -23.81 58.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.264 -0.898 . . . . 0.0 109.638 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.826 ' HB3' HD12 ' B' ' 27' ' ' LEU . 36.2 m170 -95.23 34.05 1.47 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.347 -0.846 . . . . 0.0 109.832 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.536 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.2 p -56.74 -24.84 52.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.309 -0.87 . . . . 0.0 110.015 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.685 HG23 ' O ' ' B' ' 26' ' ' THR . 14.0 t -96.71 54.06 1.29 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.35 -0.844 . . . . 0.0 109.77 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.826 HD12 ' HB3' ' B' ' 24' ' ' HIS . 12.3 mt -147.76 -32.02 0.28 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.335 -0.853 . . . . 0.0 110.788 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.536 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 9.1 p90 -108.38 167.53 9.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.864 -1.148 . . . . 0.0 110.04 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 18.9 m -100.54 -36.88 9.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.193 -0.942 . . . . 0.0 110.698 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.87 118.93 2.8 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.054 -1.029 . . . . 0.0 110.733 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -89.95 136.81 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.296 -0.877 . . . . 0.0 109.827 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.602 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 26.8 p -97.37 150.46 20.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.135 -0.978 . . . . 0.0 110.451 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.36 161.74 8.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.368 -0.833 . . . . 0.0 110.43 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -68.15 127.55 33.31 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 110.365 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.599 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 39.8 p-90 -146.26 -179.97 7.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.66 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.575 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 27.5 t-80 -162.57 174.37 12.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.931 -1.105 . . . . 0.0 110.67 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.575 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 57.1 m95 -78.6 93.54 4.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.484 -0.76 . . . . 0.0 109.806 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 13.9 t . . . . . 0 N--CA 1.491 1.61 0 O-C-N 121.27 -0.894 . . . . 0.0 110.333 -179.698 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.475 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.702 0 CA-C-O 121.359 0.599 . . . . 0.0 110.66 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.654 HG23 ' O ' ' B' ' 7' ' ' LEU . 38.7 mt -142.75 147.24 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 110.125 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.95 178.26 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.219 -0.926 . . . . 0.0 110.281 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.581 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 53.1 m -145.96 151.75 38.3 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.246 -0.909 . . . . 0.0 110.105 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.08 129.12 31.4 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.159 -0.963 . . . . 0.0 110.061 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 7.3 m -97.95 134.58 40.87 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.28 -0.888 . . . . 0.0 110.602 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.5 ' OH ' ' CG ' ' B' ' 62' ' ' PHE . 52.8 m-85 -112.84 151.6 30.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.315 -0.865 . . . . 0.0 110.065 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -76.31 -9.2 58.46 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.191 -0.943 . . . . 0.0 110.637 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 26.1 p -169.51 160.19 8.95 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.186 -0.946 . . . . 0.0 110.468 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.81 -42.15 86.37 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.196 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . 0.482 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 50.4 t-105 -53.53 -52.34 59.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.243 -0.911 . . . . 0.0 109.669 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 63.1 tt0 -58.85 -30.11 67.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.243 -0.911 . . . . 0.0 109.721 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.29 -49.18 78.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 110.464 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' B' ' 61' ' ' GLN . 2.3 p30 -61.18 -26.61 67.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.093 -1.005 . . . . 0.0 110.36 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.53 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 67.2 mt-30 -65.86 -52.09 53.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.19 -0.944 . . . . 0.0 109.851 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.661 ' O ' HG22 ' B' ' 66' ' ' VAL . 5.3 t80 -55.47 -46.3 76.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.824 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.2 mt -59.59 -22.07 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.0 110.136 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.71 -17.62 29.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.146 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -94.68 -13.96 25.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.293 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.661 HG22 ' O ' ' B' ' 62' ' ' PHE . 22.0 m -131.01 134.63 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.188 -0.945 . . . . 0.0 110.181 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -86.3 120.03 27.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.626 HD11 HG23 ' B' ' 66' ' ' VAL . 4.9 mm -89.02 103.76 6.3 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.979 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.783 ' CG ' HD12 ' B' ' 72' ' ' ILE . 45.8 Cg_endo -40.38 154.5 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.076 1.566 . . . . 0.0 110.495 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -70.5 -14.76 62.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.886 . . . . 0.0 110.486 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 28.4 m -84.58 -19.05 33.7 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.154 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.783 HD12 ' CG ' ' B' ' 69' ' ' PRO . 27.1 mt -94.32 123.71 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.33 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 24.3 m -94.8 136.64 34.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.38 -0.825 . . . . 0.0 110.495 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.595 HG12 ' N ' ' B' ' 75' ' ' SER . 99.4 t -90.79 172.07 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.264 -0.898 . . . . 0.0 110.602 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . 0.595 ' N ' HG12 ' B' ' 74' ' ' VAL . 0.4 OUTLIER -142.29 153.56 44.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.358 -0.839 . . . . 0.0 110.658 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . 0.436 ' O ' ' HB3' ' A' ' 80' ' ' SER . 52.5 p -133.56 135.74 44.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.529 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -174.61 -173.61 40.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.529 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 48.9 m-85 -147.81 149.92 33.24 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -1.117 . . . . 0.0 110.33 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.408 ' CE ' ' CE ' ' A' ' 79' ' ' MET . 26.0 mtt -118.69 173.22 6.98 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.226 -0.921 . . . . 0.0 110.351 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.477 ' C ' HG13 ' B' ' 81' ' ' ILE . 0.1 OUTLIER -139.43 107.95 5.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 110.086 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.477 HG13 ' C ' ' B' ' 80' ' ' SER . 29.7 mt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.169 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.4 mmm . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.327 0.584 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.572 ' O ' HG23 ' A' ' 2' ' ' THR . 14.8 t -88.42 125.96 61.84 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.903 . . . . 0.0 110.413 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.55 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -63.45 152.29 80.81 Favored 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 124.124 1.592 . . . . 0.0 110.209 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.418 ' C ' HG23 ' A' ' 5' ' ' VAL . 11.1 pt -144.16 164.04 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.211 -0.931 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.418 HG23 ' C ' ' A' ' 4' ' ' ILE . 41.3 t -146.14 136.88 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.159 -0.963 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.604 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.3 OUTLIER -105.2 131.38 52.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 109.599 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.508 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.4 OUTLIER -122.45 139.66 53.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.139 -0.976 . . . . 0.0 110.771 -179.407 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 80.6 tttt -142.3 170.85 14.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 110.164 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.499 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.44 -160.55 29.28 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.619 -1.393 . . . . 0.0 109.619 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.469 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 47.0 t0 -64.86 130.54 43.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -1.143 . . . . 0.0 110.336 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.1 -30.77 11.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.302 -0.873 . . . . 0.0 110.464 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -83.61 -48.39 10.26 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.263 -0.898 . . . . 0.0 110.527 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' A' ' 10' ' ' ASP . 91.7 m -57.88 -14.96 7.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 110.494 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.603 HD23 HD12 ' A' ' 17' ' ' LEU . 64.2 mt -82.48 -32.42 28.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 110.309 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -59.23 -36.62 75.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.239 -0.913 . . . . 0.0 110.031 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.7 t -70.11 -34.67 73.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.288 -0.883 . . . . 0.0 110.048 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.603 HD12 HD23 ' A' ' 14' ' ' LEU . 13.3 mt -58.77 -50.62 73.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.917 . . . . 0.0 109.939 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.575 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 34.5 ttt180 -46.23 -30.65 2.09 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.283 -0.885 . . . . 0.0 109.883 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 28.2 t80 -65.01 -46.55 80.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.399 -0.813 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -34.29 73.63 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.225 -0.922 . . . . 0.0 110.316 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.575 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.5 m-30 -66.38 -22.6 66.25 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 110.377 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 29.5 mmtt -63.62 -29.93 71.11 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.244 -0.91 . . . . 0.0 110.336 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -74.84 -47.75 28.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.5 ' HB3' HD22 ' A' ' 27' ' ' LEU . 16.0 m-70 -95.15 41.3 1.1 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.869 . . . . 0.0 109.965 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.578 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 24.5 p -56.8 -19.15 15.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 110.19 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 26' ' ' THR . 89.7 m -97.17 6.43 48.48 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.327 -0.858 . . . . 0.0 110.284 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -92.19 -7.67 47.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.291 -0.88 . . . . 0.0 110.187 -179.754 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.578 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 7.3 p90 -141.7 -176.76 4.88 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.027 -179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.432 HG22 ' N ' ' A' ' 30' ' ' ALA . 1.3 m -94.84 -62.83 1.25 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.921 . . . . 0.0 109.191 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.432 ' N ' HG22 ' A' ' 29' ' ' THR . . . -157.18 143.86 18.25 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.929 -1.107 . . . . 0.0 108.72 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.616 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.7 p -90.02 110.76 22.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.9 0 O-C-N 121.639 -0.663 . . . . 0.0 110.325 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.587 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -53.24 146.15 12.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.213 -0.929 . . . . 0.0 110.009 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.55 ' HB2' ' CG2' ' B' ' 38' ' ' THR . 7.0 t -60.9 160.82 9.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 m -67.75 122.07 17.31 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.525 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.591 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 25.4 p-90 -147.1 166.7 26.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 109.83 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.497 ' CD2' HG13 ' A' ' 48' ' ' ILE . 11.2 t-80 -162.58 -173.52 3.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.042 -1.036 . . . . 0.0 110.779 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.415 ' H ' ' CG ' ' A' ' 36' ' ' HIS . 19.4 m95 -79.53 101.67 8.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.501 -0.75 . . . . 0.0 110.379 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.54 ' CG2' ' HB2' ' B' ' 33' ' ' SER . 1.7 t . . . . . 0 N--CA 1.492 1.673 0 O-C-N 121.401 -0.812 . . . . 0.0 110.017 179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.57 0 CA-C-O 121.219 0.533 . . . . 0.0 110.475 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.508 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.7 mt -140.55 155.6 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.275 -0.891 . . . . 0.0 110.297 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.9 t -138.75 118.47 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.385 -0.822 . . . . 0.0 110.394 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.594 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 86.9 m -94.3 158.13 15.72 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.251 -0.905 . . . . 0.0 110.314 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.97 134.24 38.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.274 -0.892 . . . . 0.0 110.112 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.38 123.94 40.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.228 -0.92 . . . . 0.0 110.341 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.55 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 58.5 m-85 -103.32 146.83 27.88 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.351 -0.843 . . . . 0.0 109.85 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.09 -8.25 58.81 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.203 -0.935 . . . . 0.0 110.658 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.9 p -171.15 134.11 0.9 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.961 . . . . 0.0 110.374 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.518 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 44.4 mt-10 -50.08 -37.54 34.16 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.249 -0.907 . . . . 0.0 109.988 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 35.5 t-105 -53.83 -58.87 5.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.076 -1.015 . . . . 0.0 109.799 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -58.47 -28.74 65.62 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.161 -0.962 . . . . 0.0 110.337 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.518 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 53.6 ttp180 -59.56 -48.38 81.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.154 -0.967 . . . . 0.0 110.984 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.601 ' HA ' HD21 ' A' ' 63' ' ' LEU . 1.1 p30 -60.93 -33.67 73.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.093 -1.004 . . . . 0.0 110.741 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.519 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 57.5 mt-30 -65.65 -47.57 75.12 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.148 -0.97 . . . . 0.0 110.271 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.545 ' HA ' HD23 ' A' ' 27' ' ' LEU . 36.2 t80 -55.8 -65.24 0.63 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.38 -0.825 . . . . 0.0 110.664 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 60' ' ' ASP . 3.0 pp -59.39 -18.33 37.88 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 3.6 t -81.84 -20.68 38.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 0.0 110.128 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.52 -73.03 0.6 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.273 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 62' ' ' PHE . 34.3 m -48.14 130.18 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.113 -0.992 . . . . 0.0 109.992 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.7 108.43 6.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.179 -0.95 . . . . 0.0 110.492 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 30.9 mt -89.21 121.37 69.54 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.377 -0.827 . . . . 0.0 110.09 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -56.26 179.01 0.1 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 123.899 1.473 . . . . 0.0 110.528 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -92.19 -12.43 32.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 110.133 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.3 m -84.62 -16.69 41.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.249 -0.907 . . . . 0.0 110.305 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.522 ' CD1' ' N ' ' A' ' 72' ' ' ILE . 1.2 mp -94.06 119.39 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.243 -0.911 . . . . 0.0 110.041 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.56 139.75 30.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.32 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.55 HG22 ' N ' ' A' ' 75' ' ' SER . 8.4 p -90.71 170.54 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.245 -0.909 . . . . 0.0 110.46 -179.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.616 ' OG ' HG22 ' B' ' 81' ' ' ILE . 0.2 OUTLIER -143.85 158.84 43.42 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.345 -0.847 . . . . 0.0 110.988 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.7 p -133.37 134.19 43.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.39 -0.819 . . . . 0.0 109.854 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -167.75 -168.22 29.56 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -147.78 149.15 31.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.232 -1.158 . . . . 0.0 110.334 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 24.5 mmm -124.75 154.48 40.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 110.092 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.516 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.7 OUTLIER -130.23 103.86 6.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -0.963 . . . . 0.0 110.394 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.565 HG22 ' OG ' ' B' ' 75' ' ' SER . 13.2 pt . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.194 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.6 mmm . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.173 0.511 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . 0.576 ' O ' HG23 ' B' ' 2' ' ' THR . 14.7 t -88.65 125.42 63.14 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.269 -0.894 . . . . 0.0 110.48 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.548 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.1 Cg_endo -63.35 152.27 80.78 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.051 1.553 . . . . 0.0 110.408 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.436 ' C ' HG23 ' B' ' 5' ' ' VAL . 10.3 pt -144.12 164.39 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.232 -0.918 . . . . 0.0 110.397 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.436 HG23 ' C ' ' B' ' 4' ' ' ILE . 41.5 t -146.32 137.27 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.269 -0.895 . . . . 0.0 110.437 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.618 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.3 OUTLIER -105.4 131.0 53.37 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.349 -0.844 . . . . 0.0 109.582 179.585 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.501 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.4 OUTLIER -122.22 139.85 53.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.065 -1.022 . . . . 0.0 110.703 -179.408 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.491 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 80.5 tttt -142.35 170.43 15.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 110.176 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.491 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.81 -160.5 29.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 45.8 t0 -64.94 130.98 45.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -1.139 . . . . 0.0 110.372 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.33 -30.93 13.18 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.311 -0.868 . . . . 0.0 110.388 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -83.92 -48.25 10.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.264 -0.898 . . . . 0.0 110.508 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' B' ' 10' ' ' ASP . 99.2 m -57.78 -14.57 6.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.597 HD23 HD12 ' B' ' 17' ' ' LEU . 70.4 mt -83.04 -32.22 26.99 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.313 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -59.53 -35.91 75.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.156 -0.965 . . . . 0.0 110.065 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.447 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.7 t -70.46 -34.82 72.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.198 -0.939 . . . . 0.0 110.108 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.597 HD12 HD23 ' B' ' 14' ' ' LEU . 13.6 mt -58.84 -50.77 72.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 0.0 110.164 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.588 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 33.1 ttt180 -46.29 -30.19 1.95 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.293 -0.88 . . . . 0.0 109.903 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.473 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 30.0 t80 -65.06 -47.3 77.8 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.405 -0.809 . . . . 0.0 110.319 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.71 -33.9 72.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.209 -0.932 . . . . 0.0 110.27 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.588 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.4 m-30 -66.72 -22.87 66.05 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.0 110.293 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.7 mmtt -63.37 -30.02 71.22 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.95 . . . . 0.0 110.412 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -74.92 -48.04 26.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.195 -0.941 . . . . 0.0 110.052 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.515 ' HB3' ' HB2' ' B' ' 27' ' ' LEU . 15.8 m-70 -94.82 41.63 1.09 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.269 -0.894 . . . . 0.0 110.063 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.566 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 25.2 p -57.04 -18.87 15.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.336 -0.853 . . . . 0.0 110.14 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.512 HG22 ' O ' ' B' ' 26' ' ' THR . 86.8 m -97.27 6.11 48.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.858 . . . . 0.0 110.199 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' B' ' 62' ' ' PHE . 0.7 OUTLIER -92.26 -6.2 50.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.224 -0.922 . . . . 0.0 110.324 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.566 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 7.6 p90 -143.29 -177.1 5.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.372 -0.83 . . . . 0.0 109.836 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.442 HG22 ' N ' ' B' ' 30' ' ' ALA . 1.3 m -94.8 -63.23 1.2 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.244 -0.91 . . . . 0.0 109.214 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.442 ' N ' HG22 ' B' ' 29' ' ' THR . . . -156.8 143.09 18.17 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 120.985 -1.072 . . . . 0.0 108.625 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.594 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.5 p -89.95 110.77 22.29 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 110.268 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.591 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -52.7 145.84 11.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.4 -0.812 . . . . 0.0 110.195 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . 0.54 ' HB2' ' CG2' ' A' ' 38' ' ' THR . 6.8 t -60.66 160.86 8.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.284 -0.885 . . . . 0.0 110.102 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -67.99 122.73 18.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -0.901 . . . . 0.0 110.38 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.587 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 26.1 p-90 -147.76 167.02 25.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.618 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.478 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 12.3 t-80 -162.61 -173.66 3.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.019 -1.051 . . . . 0.0 110.815 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.41 ' H ' ' CG ' ' B' ' 36' ' ' HIS . 19.9 m95 -79.43 100.79 7.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.535 -0.728 . . . . 0.0 110.379 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . 0.55 ' CG2' ' HB2' ' A' ' 33' ' ' SER . 1.4 t . . . . . 0 N--CA 1.494 1.738 0 O-C-N 121.388 -0.82 . . . . 0.0 110.241 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 121.179 0.514 . . . . 0.0 110.596 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.501 HG23 ' O ' ' B' ' 7' ' ' LEU . 2.5 mt -140.49 155.75 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 110.338 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 62.1 t -138.57 117.89 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.591 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 93.9 m -93.77 158.49 15.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.208 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.33 134.42 37.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.973 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.5 124.63 40.55 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.223 -0.923 . . . . 0.0 110.47 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.548 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -104.09 146.79 28.22 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.335 -0.853 . . . . 0.0 109.887 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -79.17 -8.23 58.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.16 -0.963 . . . . 0.0 110.487 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 84.3 p -170.71 135.01 1.09 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.203 -0.935 . . . . 0.0 110.252 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.522 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 42.9 mt-10 -51.17 -37.43 46.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.965 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . 0.481 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 35.3 t-105 -53.82 -58.57 6.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.124 -0.985 . . . . 0.0 109.81 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -58.78 -28.54 66.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.173 -0.954 . . . . 0.0 110.327 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.522 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 54.0 ttp180 -59.47 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.143 -0.973 . . . . 0.0 110.853 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.605 ' HA ' HD21 ' B' ' 63' ' ' LEU . 1.1 p30 -61.04 -33.76 73.79 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.056 -1.027 . . . . 0.0 110.785 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.516 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 56.7 mt-30 -65.78 -47.26 75.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.062 -1.024 . . . . 0.0 110.122 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.55 ' HA ' HD23 ' B' ' 27' ' ' LEU . 37.2 t80 -55.88 -65.49 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 110.646 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' B' ' 60' ' ' ASP . 2.9 pp -59.13 -18.85 39.47 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.352 -0.842 . . . . 0.0 110.426 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 3.3 t -81.54 -20.32 40.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.127 -0.983 . . . . 0.0 110.171 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.68 -73.5 0.59 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.105 -0.997 . . . . 0.0 110.244 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.51 HG22 ' O ' ' B' ' 62' ' ' PHE . 34.0 m -47.54 130.17 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.212 -0.93 . . . . 0.0 109.937 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.53 108.7 6.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.173 -0.954 . . . . 0.0 110.426 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 25.1 mt -89.47 121.89 68.86 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.011 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.418 ' HG2' HD13 ' B' ' 72' ' ' ILE . 47.1 Cg_endo -57.0 178.55 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 123.968 1.509 . . . . 0.0 110.557 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -91.75 -12.34 34.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.206 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.1 m -84.76 -16.79 40.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.212 -0.93 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.52 ' CD1' ' N ' ' B' ' 72' ' ' ILE . 1.2 mp -93.96 119.14 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.147 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.43 139.69 30.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.328 -0.857 . . . . 0.0 110.175 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.56 HG22 ' N ' ' B' ' 75' ' ' SER . 8.4 p -90.6 170.69 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 110.518 -179.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . 0.618 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.87 158.53 43.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.432 -0.792 . . . . 0.0 111.008 179.823 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 82.8 p -133.34 134.21 43.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.453 -0.779 . . . . 0.0 109.97 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -168.21 -167.84 29.45 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -147.81 149.45 32.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.1 -1.235 . . . . 0.0 110.507 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.425 ' HE3' HG23 ' B' ' 81' ' ' ILE . 24.1 mmm -125.09 153.18 43.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.169 -0.957 . . . . 0.0 110.017 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.518 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.7 OUTLIER -128.89 104.41 7.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.211 -0.931 . . . . 0.0 110.24 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.616 HG22 ' OG ' ' A' ' 75' ' ' SER . 13.7 pt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.181 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 mtm . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.171 0.51 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -94.72 118.09 66.85 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.175 -0.953 . . . . 0.0 110.15 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 50.6 Cg_endo -53.54 147.0 40.37 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.093 1.575 . . . . 0.0 110.411 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.446 HG23 ' O ' ' A' ' 2' ' ' THR . 1.1 pt -143.06 109.93 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.34 -0.85 . . . . 0.0 110.024 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.95 153.92 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 110.424 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.566 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 0.0 OUTLIER -134.71 117.14 15.7 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.372 -0.83 . . . . 0.0 109.821 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.55 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.8 OUTLIER -112.74 145.36 40.68 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 -179.716 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 72' ' ' ILE . 20.4 tttm -143.42 169.8 16.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.265 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.79 -157.35 27.24 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.481 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 81.9 m-20 -64.79 123.5 19.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.179 -1.189 . . . . 0.0 109.948 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.806 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.77 -43.94 48.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.842 . . . . 0.0 110.632 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.42 -48.22 82.68 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.241 -0.912 . . . . 0.0 110.451 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.4 m -57.96 -28.19 64.12 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.301 -0.874 . . . . 0.0 110.419 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.806 HD12 ' HA ' ' A' ' 11' ' ' ALA . 97.5 mt -65.69 -30.03 70.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.214 -0.929 . . . . 0.0 110.042 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.1 -36.92 78.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.32 -0.862 . . . . 0.0 110.147 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.548 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 4.6 t -70.06 -40.56 75.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 110.762 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.405 HD11 ' CD1' ' A' ' 72' ' ' ILE . 1.0 OUTLIER -58.75 -52.03 67.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.973 -1.079 . . . . 0.0 110.188 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.527 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 7.3 ttt-85 -48.31 -27.6 2.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.886 . . . . 0.0 110.258 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.548 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 64.6 t80 -64.65 -25.74 68.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.224 -0.922 . . . . 0.0 110.074 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -83.55 -25.33 31.07 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.228 -0.92 . . . . 0.0 109.919 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.565 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.2 m-30 -66.5 -22.62 66.18 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.387 -0.821 . . . . 0.0 110.439 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -63.32 -47.35 82.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.06 -20.26 59.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.189 -0.944 . . . . 0.0 109.839 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.895 ' HB3' HD12 ' A' ' 27' ' ' LEU . 20.8 m170 -95.42 39.67 1.12 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 110.161 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.493 ' SG ' ' N ' ' A' ' 26' ' ' THR . 19.3 p -57.06 -36.2 70.24 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.11 -0.994 . . . . 0.0 110.368 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.551 ' O ' HG23 ' A' ' 26' ' ' THR . 8.7 t -97.27 67.04 2.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.134 -0.979 . . . . 0.0 110.543 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.895 HD12 ' HB3' ' A' ' 24' ' ' HIS . 10.0 mt -148.11 -43.95 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.258 -0.901 . . . . 0.0 110.074 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -107.11 170.25 8.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.208 -0.932 . . . . 0.0 109.725 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.445 HG23 ' OD2' ' A' ' 54' ' ' ASP . 0.2 OUTLIER -100.34 -33.84 10.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.087 -1.008 . . . . 0.0 111.046 -179.348 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.417 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -159.73 116.82 2.6 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.097 . . . . 0.0 110.924 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.46 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.4 p -90.03 131.33 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 110.019 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.582 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 53.8 p -86.02 149.23 25.31 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.251 -0.905 . . . . 0.0 110.302 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.0 t -61.36 161.58 9.01 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.142 -0.974 . . . . 0.0 110.013 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.87 128.37 36.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.326 -0.859 . . . . 0.0 110.406 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 36.6 p-90 -146.36 -179.25 6.62 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.294 -0.879 . . . . 0.0 109.77 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.565 ' CE1' ' O ' ' A' ' 37' ' ' TRP . 7.5 t-80 -162.56 169.71 19.79 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.1 -1.0 . . . . 0.0 110.208 -179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.565 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 56.4 m95 -79.07 110.01 13.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.212 -0.93 . . . . 0.0 110.159 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t . . . . . 0 N--CA 1.492 1.625 0 O-C-N 121.274 -0.891 . . . . 0.0 110.183 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.502 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.72 0 CA-C-O 121.293 0.568 . . . . 0.0 110.516 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.55 HG23 ' O ' ' A' ' 7' ' ' LEU . 10.0 mt -142.48 157.71 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.226 -0.921 . . . . 0.0 109.915 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.522 HG13 ' N ' ' A' ' 50' ' ' THR . 0.4 OUTLIER -139.0 179.51 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.154 -0.966 . . . . 0.0 110.521 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.566 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 49.2 m -145.65 153.77 41.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.391 -0.818 . . . . 0.0 109.571 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.91 128.79 35.28 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.034 -1.042 . . . . 0.0 110.342 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -96.98 127.13 42.64 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.368 -0.833 . . . . 0.0 110.168 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.536 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 53.8 m-85 -106.85 147.79 29.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.31 -0.869 . . . . 0.0 110.064 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.445 ' OD2' HG23 ' A' ' 29' ' ' THR . 0.3 OUTLIER -71.44 -6.02 37.2 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.847 . . . . 0.0 110.773 -179.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 p -175.84 174.51 2.15 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -1.0 . . . . 0.0 110.594 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.98 -44.98 45.18 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.317 -0.865 . . . . 0.0 110.353 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.505 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 67.0 t-105 -53.62 -50.09 66.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.175 -0.953 . . . . 0.0 109.916 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 53.9 tt0 -57.08 -39.56 75.21 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 110.586 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.488 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 6.4 ttp180 -59.26 -40.67 86.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.98 -1.075 . . . . 0.0 110.643 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.505 ' OD2' ' O ' ' A' ' 57' ' ' TRP . 0.0 OUTLIER -61.45 -39.61 91.48 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.096 -1.003 . . . . 0.0 110.749 -179.429 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 23.1 mt-30 -65.4 -44.12 88.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.226 -0.921 . . . . 0.0 110.481 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.754 ' O ' HG22 ' A' ' 66' ' ' VAL . 86.2 t80 -55.3 -42.01 73.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.179 -0.951 . . . . 0.0 110.119 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.5 mt -59.61 -13.24 8.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.7 p -98.83 -14.87 19.47 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.194 -0.941 . . . . 0.0 110.423 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 4.5 mm-40 -96.48 -12.65 23.87 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.173 -0.954 . . . . 0.0 109.992 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.754 HG22 ' O ' ' A' ' 62' ' ' PHE . 13.8 m -133.22 105.21 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.302 -0.874 . . . . 0.0 110.084 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -62.37 123.66 18.84 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 110.398 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.43 ' HA ' HD13 ' A' ' 68' ' ' ILE . 25.3 mm -88.95 113.45 56.1 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.293 -0.88 . . . . 0.0 110.266 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.462 ' HG2' ' CG1' ' A' ' 72' ' ' ILE . 44.3 Cg_endo -56.61 152.33 41.72 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.042 1.548 . . . . 0.0 110.499 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -68.75 -11.85 60.79 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.275 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.2 m -84.64 -24.89 28.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.198 -0.939 . . . . 0.0 109.974 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.471 HG23 ' O ' ' A' ' 8' ' ' LYS . 12.3 mt -94.12 123.45 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.466 -0.771 . . . . 0.0 110.148 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -94.48 138.0 32.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.23 -0.919 . . . . 0.0 110.023 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -91.26 172.59 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.204 -0.935 . . . . 0.0 110.574 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.549 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.89 155.41 44.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.566 -0.708 . . . . 0.0 110.381 179.524 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.482 ' O ' ' HB3' ' B' ' 80' ' ' SER . 0.6 OUTLIER -133.19 136.13 45.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 110.186 179.26 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.41 ' O ' HG13 ' A' ' 4' ' ' ILE . . . -176.39 -172.33 40.98 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.446 ' HA ' HG12 ' A' ' 4' ' ' ILE . 97.7 m-85 -148.14 155.18 41.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.09 -1.241 . . . . 0.0 110.64 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' B' ' 79' ' ' MET . 27.2 mtt -123.64 174.79 7.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.333 -0.855 . . . . 0.0 110.168 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.488 ' C ' ' CG1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -139.08 109.19 6.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 110.085 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.488 ' CG1' ' C ' ' A' ' 80' ' ' SER . 10.8 mt . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.173 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.1 mtm . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.276 0.56 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . 0.43 ' O ' HG23 ' B' ' 4' ' ' ILE . 0.0 OUTLIER -94.07 118.07 67.19 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.319 -0.863 . . . . 0.0 110.078 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 49.8 Cg_endo -53.9 147.61 41.42 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.942 1.496 . . . . 0.0 110.496 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.434 HG12 ' CA ' ' B' ' 78' ' ' PHE . 1.1 pt -142.95 109.52 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.984 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -93.8 153.13 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.306 -0.871 . . . . 0.0 110.271 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.536 ' HB2' ' HB3' ' B' ' 75' ' ' SER . 0.0 OUTLIER -134.13 117.17 16.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.332 -0.855 . . . . 0.0 109.952 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.565 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.8 OUTLIER -112.87 145.5 40.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.178 -0.951 . . . . 0.0 110.33 -179.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.468 ' O ' HG23 ' B' ' 72' ' ' ILE . 19.9 tttm -143.46 169.76 17.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.294 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.71 -157.38 27.26 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 81.8 m-20 -64.57 123.1 18.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.18 -1.188 . . . . 0.0 110.041 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.807 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.9 -43.24 49.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.297 -0.877 . . . . 0.0 110.571 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -60.48 -48.33 82.22 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.194 -0.941 . . . . 0.0 110.358 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.9 m -58.31 -28.42 65.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.452 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' B' ' 11' ' ' ALA . 94.3 mt -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.905 . . . . 0.0 110.145 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -60.12 -36.96 78.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.3 -0.875 . . . . 0.0 110.19 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 4.7 t -70.0 -40.55 75.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 110.64 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.41 HD11 ' CD1' ' B' ' 72' ' ' ILE . 1.0 OUTLIER -58.83 -51.81 68.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.014 -1.054 . . . . 0.0 110.252 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.521 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 7.3 ttt-85 -48.29 -27.4 2.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.37 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.547 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 65.4 t80 -64.6 -26.33 68.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.277 -0.889 . . . . 0.0 110.15 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -82.89 -25.27 32.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.915 . . . . 0.0 109.943 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.575 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.3 m-30 -66.46 -23.04 66.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.359 -0.838 . . . . 0.0 110.425 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -63.21 -47.01 84.35 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.25 -0.906 . . . . 0.0 110.304 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.11 -20.71 59.31 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.179 -0.951 . . . . 0.0 109.859 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.899 ' HB3' HD12 ' B' ' 27' ' ' LEU . 20.7 m170 -95.11 40.01 1.11 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.462 -0.773 . . . . 0.0 110.072 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' B' ' 26' ' ' THR . 18.5 p -57.3 -36.49 71.13 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.91 . . . . 0.0 110.354 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.527 HG23 ' O ' ' B' ' 26' ' ' THR . 7.0 t -97.21 67.05 2.13 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.149 -0.969 . . . . 0.0 110.582 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.899 HD12 ' HB3' ' B' ' 24' ' ' HIS . 10.1 mt -148.16 -44.38 0.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.204 -0.935 . . . . 0.0 110.049 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -106.49 170.31 8.0 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.204 -0.935 . . . . 0.0 109.763 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.444 HG23 ' OD2' ' B' ' 54' ' ' ASP . 0.2 OUTLIER -100.26 -33.95 10.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.021 -1.05 . . . . 0.0 111.005 -179.314 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.401 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -159.67 116.91 2.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.991 -1.068 . . . . 0.0 110.866 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.479 ' O ' HG13 ' B' ' 31' ' ' VAL . 6.9 p -90.11 130.1 39.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.262 -0.899 . . . . 0.0 109.935 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.58 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 57.6 p -84.58 149.37 25.92 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.223 -0.923 . . . . 0.0 110.295 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -61.45 162.22 8.34 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.088 -1.008 . . . . 0.0 110.219 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.98 127.85 34.36 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.896 . . . . 0.0 110.269 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.582 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 37.9 p-90 -146.14 -178.92 6.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.22 -0.925 . . . . 0.0 109.882 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.576 ' CE1' ' O ' ' B' ' 37' ' ' TRP . 7.9 t-80 -162.56 169.38 20.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.054 -1.029 . . . . 0.0 110.414 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.576 ' O ' ' CE1' ' B' ' 36' ' ' HIS . 58.1 m95 -79.07 110.15 14.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 109.903 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t . . . . . 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.225 -179.818 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.503 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.169 0.509 . . . . 0.0 110.621 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.565 HG23 ' O ' ' B' ' 7' ' ' LEU . 9.2 mt -142.65 157.95 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.345 -0.847 . . . . 0.0 109.963 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . 0.532 HG13 ' N ' ' B' ' 50' ' ' THR . 0.4 OUTLIER -139.14 179.95 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.123 -0.985 . . . . 0.0 110.637 -179.751 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.532 ' N ' HG13 ' B' ' 49' ' ' VAL . 54.5 m -145.9 153.07 40.44 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 109.811 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.3 128.84 36.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.166 -0.959 . . . . 0.0 110.464 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 4.7 m -97.12 126.92 42.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.371 -0.83 . . . . 0.0 110.246 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.522 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 56.6 m-85 -106.87 148.17 28.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.258 -0.901 . . . . 0.0 110.013 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.444 ' OD2' HG23 ' B' ' 29' ' ' THR . 0.3 OUTLIER -72.15 -6.41 42.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.805 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 p -174.81 174.89 2.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.064 -1.023 . . . . 0.0 110.264 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -75.91 -44.14 41.75 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 67.0 t-105 -53.64 -49.95 66.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.881 . . . . 0.0 110.197 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.0 tt0 -57.3 -39.39 75.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.22 -0.925 . . . . 0.0 110.645 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.467 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 6.3 ttp180 -59.29 -41.35 88.75 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.138 -0.976 . . . . 0.0 110.714 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.485 ' OD2' ' O ' ' B' ' 57' ' ' TRP . 0.0 OUTLIER -61.19 -39.18 89.22 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.124 -0.985 . . . . 0.0 110.741 -179.386 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 23.3 mt-30 -65.42 -44.24 87.97 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.089 -1.007 . . . . 0.0 110.437 -179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.745 ' O ' HG22 ' B' ' 66' ' ' VAL . 83.7 t80 -55.28 -41.8 72.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.137 -0.977 . . . . 0.0 109.935 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.0 mt -59.68 -12.56 7.18 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.246 -0.909 . . . . 0.0 110.176 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 12.3 p -99.5 -14.79 18.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.228 -0.92 . . . . 0.0 110.488 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' B' ' 61' ' ' GLN . 4.5 mm-40 -96.45 -12.68 23.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 110.113 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.745 HG22 ' O ' ' B' ' 62' ' ' PHE . 13.1 m -133.26 104.65 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.351 -0.843 . . . . 0.0 110.171 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.6 tptp -62.0 123.86 19.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.428 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.421 ' HA ' HD13 ' B' ' 68' ' ' ILE . 25.3 mm -88.95 113.42 55.98 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.288 -0.883 . . . . 0.0 110.298 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.473 ' HG2' ' CG1' ' B' ' 72' ' ' ILE . 45.0 Cg_endo -56.4 152.6 38.73 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.957 1.504 . . . . 0.0 110.423 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -69.29 -11.86 61.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.219 -0.926 . . . . 0.0 110.29 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 10.7 m -84.48 -24.63 29.35 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.252 -0.905 . . . . 0.0 109.882 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.473 ' CG1' ' HG2' ' B' ' 69' ' ' PRO . 12.2 mt -94.37 123.41 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.275 -0.89 . . . . 0.0 110.267 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 99.1 m -94.53 138.07 32.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.163 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.424 ' H ' HG23 ' B' ' 74' ' ' VAL . 1.7 t -91.32 172.49 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . 0.536 ' HB3' ' HB2' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -143.09 155.65 44.65 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.517 -0.74 . . . . 0.0 110.346 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . 0.458 ' O ' ' HB3' ' A' ' 80' ' ' SER . 0.6 OUTLIER -133.41 135.63 44.74 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.18 -0.95 . . . . 0.0 110.203 179.361 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.405 ' O ' HG13 ' B' ' 4' ' ' ILE . . . -175.35 -172.21 40.03 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.434 ' CA ' HG12 ' B' ' 4' ' ' ILE . 97.7 m-85 -147.98 155.12 41.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.109 -1.23 . . . . 0.0 110.524 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' A' ' 79' ' ' MET . 27.4 mtt -123.98 173.75 8.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.405 -0.809 . . . . 0.0 110.052 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.487 ' C ' ' CG1' ' B' ' 81' ' ' ILE . 0.0 OUTLIER -138.23 109.14 6.71 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.19 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.487 ' CG1' ' C ' ' B' ' 80' ' ' SER . 10.4 mt . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.108 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' A' ' 2' ' ' THR . 70.1 mtm . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.213 0.53 . . . . 0.0 110.176 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' A' ' 1' ' ' MET . 76.7 m -43.71 105.23 0.42 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 46.5 Cg_endo -56.42 157.65 17.77 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 O-C-N 124.15 1.605 . . . . 0.0 110.743 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.541 HG22 HG22 ' A' ' 52' ' ' THR . 2.5 pp -144.09 168.28 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.37 -0.832 . . . . 0.0 109.947 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.521 ' O ' HG13 ' A' ' 5' ' ' VAL . 8.8 p -146.11 129.82 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.949 . . . . 0.0 110.544 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.564 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 2.7 m170 -106.35 122.94 47.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.203 -0.936 . . . . 0.0 110.072 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.811 ' O ' HG23 ' A' ' 48' ' ' ILE . 11.8 mt -114.36 146.87 40.01 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.179 -0.951 . . . . 0.0 110.127 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.511 ' HB2' HG12 ' A' ' 48' ' ' ILE . 31.9 ttpt -141.43 165.58 27.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.186 -0.946 . . . . 0.0 110.721 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.42 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 154.28 -168.11 32.5 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.454 ' O ' ' HB ' ' A' ' 13' ' ' THR . 9.3 m-20 -64.71 142.27 58.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.183 -1.187 . . . . 0.0 109.921 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.89 -68.5 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.222 -0.924 . . . . 0.0 110.282 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -44.27 -43.56 7.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.3 -0.875 . . . . 0.0 110.245 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.592 ' CG2' HD11 ' A' ' 72' ' ' ILE . 7.0 m -58.11 -28.52 64.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.161 -0.962 . . . . 0.0 110.309 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 11' ' ' ALA . 17.6 mt -77.17 -29.8 54.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.272 -0.892 . . . . 0.0 110.164 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 15' ' ' LYS . 13.5 ttmt -60.01 -34.59 73.56 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.288 -0.882 . . . . 0.0 110.054 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 12.3 t -70.13 -37.08 75.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.355 -0.841 . . . . 0.0 110.664 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.443 HD11 HG12 ' A' ' 72' ' ' ILE . 20.7 mt -58.98 -48.17 82.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.137 -0.977 . . . . 0.0 110.45 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.3 ttp180 -47.33 -33.46 5.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.397 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.541 ' CD1' ' C ' ' A' ' 19' ' ' TYR . 4.2 t80 -64.59 -38.44 91.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.29 -0.882 . . . . 0.0 110.305 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -69.46 -33.16 72.51 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.18 -0.95 . . . . 0.0 110.213 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.536 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.48 -31.74 72.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.191 -0.943 . . . . 0.0 110.276 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.46 -16.54 60.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.227 -0.921 . . . . 0.0 110.148 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -75.02 -41.0 60.18 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.651 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.967 ' CG ' HD12 ' A' ' 27' ' ' LEU . 5.0 m-70 -95.08 75.97 3.49 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.305 -0.872 . . . . 0.0 109.559 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 p -58.18 -6.45 0.63 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.484 -0.76 . . . . 0.0 111.933 -179.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.82 31.98 1.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.584 -1.322 . . . . 0.0 111.1 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.967 HD12 ' CG ' ' A' ' 24' ' ' HIS . 2.1 mt -93.1 -35.46 13.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.437 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -107.94 169.68 8.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.17 -0.957 . . . . 0.0 110.318 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.517 ' OG1' ' N ' ' A' ' 54' ' ' ASP . 36.3 m -100.2 -34.36 10.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.286 -0.884 . . . . 0.0 111.131 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.51 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.75 117.72 2.7 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.977 -1.077 . . . . 0.0 110.72 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.595 ' O ' HG13 ' A' ' 31' ' ' VAL . 4.9 p -90.69 105.64 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.127 -0.983 . . . . 0.0 109.9 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.465 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 1.4 p -68.58 155.06 40.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.142 -0.974 . . . . 0.0 110.404 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.6 p -61.37 163.83 6.22 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 109.992 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -67.99 125.58 26.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.222 -0.924 . . . . 0.0 110.471 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.527 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 25.9 p-90 -146.11 173.34 12.28 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.079 -1.013 . . . . 0.0 109.738 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.527 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 11.0 p80 -162.61 -175.38 4.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.084 -1.01 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 68.3 m95 -79.31 155.03 28.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.278 -0.889 . . . . 0.0 110.105 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.489 1.49 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 179.911 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.491 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.645 0 CA-C-O 121.243 0.544 . . . . 0.0 109.78 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.811 HG23 ' O ' ' A' ' 7' ' ' LEU . 43.6 mt -142.69 141.9 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.118 -0.989 . . . . 0.0 110.601 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 t -111.63 117.32 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.414 -0.804 . . . . 0.0 109.958 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.58 ' C ' HD12 ' A' ' 51' ' ' LEU . 50.3 m -93.69 146.58 23.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 110.008 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.58 HD12 ' C ' ' A' ' 50' ' ' THR . 5.4 mp -135.62 129.73 33.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.128 -0.983 . . . . 0.0 110.273 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.541 HG22 HG22 ' A' ' 4' ' ' ILE . 0.6 OUTLIER -97.95 136.4 38.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.548 -0.72 . . . . 0.0 110.114 179.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.522 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 89.9 m-85 -110.42 150.6 28.59 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.85 . . . . 0.0 109.865 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.517 ' N ' ' OG1' ' A' ' 29' ' ' THR . 1.8 t0 -84.52 -10.06 57.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.976 . . . . 0.0 110.458 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.51 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 0.4 OUTLIER -149.06 150.83 33.43 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.118 -0.989 . . . . 0.0 110.314 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.96 -56.21 9.86 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.523 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 12.3 p90 -53.95 -36.81 63.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.195 -0.941 . . . . 0.0 110.003 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.523 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 64.7 tt0 -58.32 -49.22 77.97 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.262 -0.899 . . . . 0.0 110.22 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -58.71 -36.27 73.99 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.264 -0.897 . . . . 0.0 110.112 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.661 ' HA ' HD21 ' A' ' 63' ' ' LEU . 18.8 m-20 -61.42 -42.24 98.43 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.28 -0.888 . . . . 0.0 110.528 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.49 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 62.1 mt-30 -65.92 -37.32 85.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.06 -1.025 . . . . 0.0 110.308 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.547 ' CD1' ' N ' ' A' ' 63' ' ' LEU . 10.5 t80 -55.41 -63.75 1.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.204 -0.935 . . . . 0.0 110.276 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 60' ' ' ASP . 3.2 pp -59.79 -17.1 33.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.251 -0.906 . . . . 0.0 110.585 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.443 ' HB3' ' O ' ' A' ' 60' ' ' ASP . 0.9 OUTLIER -83.87 -20.81 32.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.948 . . . . 0.0 110.434 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 41.5 mt-30 -95.53 -61.92 1.38 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.166 -0.959 . . . . 0.0 110.17 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.486 ' H ' HG22 ' A' ' 66' ' ' VAL . 15.7 m -79.63 70.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.156 -0.965 . . . . 0.0 109.876 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -44.85 117.98 1.49 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.551 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.496 HG12 ' HB ' ' A' ' 72' ' ' ILE . 0.9 OUTLIER -88.61 134.31 34.34 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 110.141 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.439 ' HG2' HD13 ' A' ' 72' ' ' ILE . 47.0 Cg_endo -55.25 176.52 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 123.875 1.46 . . . . 0.0 110.66 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.3 tptt -81.94 3.24 27.14 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.29 -33.19 24.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 109.795 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.592 HD11 ' CG2' ' A' ' 13' ' ' THR . 2.0 mp -93.92 123.21 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.412 -0.805 . . . . 0.0 109.903 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.6 m -94.61 138.17 32.81 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.46 HG22 ' N ' ' A' ' 75' ' ' SER . 7.7 p -90.86 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 0.0 111.171 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.564 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -143.69 157.57 44.3 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.736 -0.603 . . . . 0.0 110.058 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.9 p -133.13 133.12 42.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.187 -0.946 . . . . 0.0 110.172 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.7 -165.69 15.76 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' B' ' 78' ' ' PHE . 55.9 m-85 -147.88 153.63 39.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.185 -1.185 . . . . 0.0 110.356 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 93.5 mmm -139.26 152.78 47.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.219 -0.926 . . . . 0.0 110.2 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.5 t -134.96 100.57 4.62 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.229 -0.919 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 24.9 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.254 179.796 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' B' ' 2' ' ' THR . 69.6 mtm . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.236 0.541 . . . . 0.0 110.106 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' B' ' 1' ' ' MET . 54.7 m -43.79 104.25 0.37 Allowed Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.324 -0.86 . . . . 0.0 110.169 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.53 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.1 Cg_endo -55.38 157.73 14.04 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.14 1.6 . . . . 0.0 110.746 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.525 HG22 HG22 ' B' ' 52' ' ' THR . 2.6 pp -144.23 168.55 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.297 -0.877 . . . . 0.0 110.068 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.523 ' O ' HG13 ' B' ' 5' ' ' VAL . 9.4 p -146.45 129.76 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.154 -0.966 . . . . 0.0 110.552 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.572 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 2.9 m170 -106.52 123.34 47.95 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.268 -0.895 . . . . 0.0 110.152 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.805 ' O ' HG23 ' B' ' 48' ' ' ILE . 12.1 mt -114.47 146.61 40.45 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.112 -0.992 . . . . 0.0 110.163 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.513 ' HB2' HG12 ' B' ' 48' ' ' ILE . 31.7 ttpt -141.48 165.42 27.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.08 -1.013 . . . . 0.0 110.723 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.425 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 154.44 -167.96 32.56 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . 0.438 ' O ' ' HB ' ' B' ' 13' ' ' THR . 8.8 m-20 -64.77 142.84 58.29 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.272 -1.134 . . . . 0.0 109.99 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.643 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.89 -68.72 0.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.231 -0.918 . . . . 0.0 110.529 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -44.43 -43.61 7.86 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 110.358 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.601 ' CG2' HD11 ' B' ' 72' ' ' ILE . 6.3 m -57.83 -28.74 64.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.164 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' B' ' 11' ' ' ALA . 19.9 mt -76.53 -30.31 57.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' B' ' 15' ' ' LYS . 12.5 ttmt -59.96 -35.11 74.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -0.855 . . . . 0.0 110.156 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.495 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 12.0 t -69.87 -36.75 75.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.202 -0.937 . . . . 0.0 110.425 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.44 HD11 HG12 ' B' ' 72' ' ' ILE . 19.0 mt -58.81 -48.62 80.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.092 -1.005 . . . . 0.0 110.541 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 19.0 ttp180 -47.5 -32.78 5.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.17 -0.956 . . . . 0.0 110.349 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.536 ' CD1' ' C ' ' B' ' 19' ' ' TYR . 4.6 t80 -64.76 -38.12 89.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.178 -0.951 . . . . 0.0 110.329 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -69.91 -33.4 72.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.201 -0.937 . . . . 0.0 110.264 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.54 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.34 -31.42 72.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.263 -0.898 . . . . 0.0 110.375 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.39 -16.83 61.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.204 -0.935 . . . . 0.0 110.254 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -74.89 -41.17 60.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.193 -0.942 . . . . 0.0 109.75 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.971 ' CG ' HD12 ' B' ' 27' ' ' LEU . 5.1 m-70 -94.89 76.11 3.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.263 -0.898 . . . . 0.0 109.368 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.03 -6.84 0.65 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.441 -0.787 . . . . 0.0 112.088 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.67 31.88 1.65 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.589 -1.319 . . . . 0.0 111.099 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.971 HD12 ' CG ' ' B' ' 24' ' ' HIS . 2.0 mt -93.02 -34.95 13.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.057 -1.027 . . . . 0.0 110.355 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -108.04 169.96 8.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.524 ' OG1' ' N ' ' B' ' 54' ' ' ASP . 40.1 m -100.32 -34.82 9.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.28 -0.888 . . . . 0.0 111.077 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.484 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.83 118.21 2.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.965 -1.085 . . . . 0.0 110.643 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.587 ' O ' HG13 ' B' ' 31' ' ' VAL . 5.4 p -90.82 105.17 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.116 -0.99 . . . . 0.0 110.055 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.488 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 1.7 p -68.22 154.76 41.08 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.146 -0.972 . . . . 0.0 110.292 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 12.9 p -61.36 164.64 5.36 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.173 -0.954 . . . . 0.0 110.153 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.13 124.93 24.79 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.292 -0.88 . . . . 0.0 110.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.54 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 25.1 p-90 -145.57 173.5 11.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.026 -1.046 . . . . 0.0 109.789 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.54 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 10.4 p80 -162.69 -175.06 4.24 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.614 -179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 67.1 m95 -79.8 155.66 27.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.333 -0.854 . . . . 0.0 110.063 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.492 1.664 0 O-C-N 121.13 -0.981 . . . . 0.0 110.23 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.507 ' HA ' ' HB3' ' B' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.112 0.482 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.805 HG23 ' O ' ' B' ' 7' ' ' LEU . 45.1 mt -142.66 142.34 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.169 -0.957 . . . . 0.0 110.645 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 t -112.01 117.06 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.443 -0.786 . . . . 0.0 109.716 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.577 ' C ' HD12 ' B' ' 51' ' ' LEU . 54.5 m -93.15 147.4 22.91 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.251 -0.906 . . . . 0.0 109.916 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.577 HD12 ' C ' ' B' ' 50' ' ' THR . 5.3 mp -136.28 129.77 31.98 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 110.317 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.525 HG22 HG22 ' B' ' 4' ' ' ILE . 0.6 OUTLIER -98.14 136.24 38.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 179.804 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.53 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 89.1 m-85 -110.56 150.74 28.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.294 -0.879 . . . . 0.0 109.839 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.524 ' N ' ' OG1' ' B' ' 29' ' ' THR . 1.4 t0 -84.7 -10.16 57.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.133 -0.979 . . . . 0.0 110.516 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . 0.534 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 0.4 OUTLIER -148.49 151.51 35.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.153 -0.967 . . . . 0.0 110.243 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.31 -56.03 10.0 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.279 -0.888 . . . . 0.0 109.978 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . 0.534 ' CE2' ' HB3' ' B' ' 55' ' ' SER . 12.3 p90 -54.21 -37.15 64.25 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 0.0 110.228 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.53 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 63.8 tt0 -58.37 -48.32 80.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -0.929 . . . . 0.0 110.206 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -59.14 -36.59 75.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.149 -0.969 . . . . 0.0 110.154 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.637 ' HA ' HD21 ' B' ' 63' ' ' LEU . 19.3 m-20 -61.31 -41.91 97.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 110.437 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 61.6 mt-30 -65.91 -37.32 85.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 0.0 110.145 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.546 ' CD1' ' N ' ' B' ' 63' ' ' LEU . 10.5 t80 -55.64 -63.57 1.13 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.116 -0.99 . . . . 0.0 110.262 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.637 HD21 ' HA ' ' B' ' 60' ' ' ASP . 3.3 pp -59.93 -16.65 31.48 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.272 -0.892 . . . . 0.0 110.516 -179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' B' ' 60' ' ' ASP . 1.0 OUTLIER -84.5 -21.09 30.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.244 -0.91 . . . . 0.0 110.376 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 39.3 mt-30 -95.22 -62.85 1.23 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.982 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.477 ' H ' HG22 ' B' ' 66' ' ' VAL . 16.3 m -78.57 70.88 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.049 -1.032 . . . . 0.0 109.816 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -45.75 118.37 1.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.289 -0.882 . . . . 0.0 110.472 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.478 HG12 ' HB ' ' B' ' 72' ' ' ILE . 0.9 OUTLIER -88.71 134.91 32.94 Favored Pre-proline 0 N--CA 1.486 1.35 0 O-C-N 121.232 -0.917 . . . . 0.0 110.331 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.464 ' HG2' HD13 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -55.88 176.8 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.048 1.552 . . . . 0.0 110.663 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -82.61 3.23 29.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.351 -0.843 . . . . 0.0 110.356 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -32.79 24.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.131 -0.981 . . . . 0.0 109.696 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.601 HD11 ' CG2' ' B' ' 13' ' ' THR . 2.0 mp -94.48 123.61 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.552 -0.717 . . . . 0.0 109.985 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.5 m -95.06 138.42 32.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.155 -0.965 . . . . 0.0 109.982 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.455 HG22 ' N ' ' B' ' 75' ' ' SER . 7.4 p -90.78 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.151 -0.968 . . . . 0.0 110.995 -178.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . 0.572 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.62 157.65 44.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.763 -0.585 . . . . 0.0 110.173 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.2 p -133.49 133.57 42.39 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.0 110.281 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.87 -165.15 14.89 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 78' ' ' PHE . 55.7 m-85 -148.15 153.12 38.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.176 -1.19 . . . . 0.0 110.207 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 95.1 mmm -138.59 152.68 48.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t -135.09 100.58 4.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 110.338 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.173 179.945 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.7 mtp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.183 0.516 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.29 132.84 43.93 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.002 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.49 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 43.1 Cg_endo -91.2 166.19 3.65 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.78 1.411 . . . . 0.0 110.668 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.438 HG21 ' HG3' ' A' ' 79' ' ' MET . 1.4 pt -144.05 179.62 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.408 -0.808 . . . . 0.0 110.154 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.534 HG13 ' CG2' ' A' ' 74' ' ' VAL . 1.0 OUTLIER -146.33 129.88 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.245 -0.909 . . . . 0.0 110.193 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.563 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.38 121.48 43.99 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.308 -0.87 . . . . 0.0 110.088 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 1.058 ' O ' HG23 ' A' ' 48' ' ' ILE . 4.2 tp -119.74 139.92 51.53 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.192 -0.943 . . . . 0.0 110.148 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.514 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.6 ttpp -142.39 167.13 22.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 0.0 110.573 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.514 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 154.74 -166.49 32.39 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.489 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 65.4 m-20 -64.65 136.73 57.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -1.233 . . . . 0.0 109.968 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.409 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.78 -46.57 59.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 111.169 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -63.51 -46.8 84.38 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.118 -0.989 . . . . 0.0 111.196 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.489 ' OG1' ' HB2' ' A' ' 10' ' ' ASP . 6.4 m -57.72 -31.19 66.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.901 -1.125 . . . . 0.0 110.383 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.483 HD12 ' O ' ' A' ' 10' ' ' ASP . 6.7 mt -75.06 -25.44 58.63 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -59.46 -40.63 87.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.545 -0.722 . . . . 0.0 110.294 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 22.4 t -70.12 -36.89 75.14 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.222 -0.924 . . . . 0.0 110.527 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 mt -58.85 -54.79 43.09 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.085 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.493 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 26.9 ttt180 -47.28 -26.29 1.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.54 -0.725 . . . . 0.0 110.762 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.489 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 10.9 t80 -64.92 -50.9 64.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 0.0 110.747 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.48 -13.54 62.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.474 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.493 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 2.4 m-30 -66.33 -35.4 80.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.203 -0.936 . . . . 0.0 110.076 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.3 mmmt -63.52 -29.83 71.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.32 -0.862 . . . . 0.0 110.261 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -74.91 -41.09 60.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.21 -0.931 . . . . 0.0 109.762 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.705 ' HB3' HD22 ' A' ' 27' ' ' LEU . 68.2 m-70 -95.14 37.27 1.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.32 -0.863 . . . . 0.0 109.94 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.605 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 8.7 p -57.22 -14.35 4.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.311 -0.868 . . . . 0.0 110.428 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 p -96.72 6.67 48.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.103 -0.998 . . . . 0.0 110.182 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' A' ' 24' ' ' HIS . 6.6 mp -92.39 -35.04 13.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 110.376 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 39.3 p90 -111.05 165.77 11.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.189 -0.944 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.06 -30.47 12.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.233 -0.917 . . . . 0.0 110.737 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.568 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.66 114.48 2.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.226 -0.921 . . . . 0.0 110.557 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.766 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.7 p -89.98 99.69 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.119 -0.988 . . . . 0.0 110.135 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.481 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -50.74 147.9 4.44 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.217 -0.927 . . . . 0.0 110.179 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t -60.82 164.47 4.75 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.085 -1.01 . . . . 0.0 109.829 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.7 121.21 15.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.173 -0.954 . . . . 0.0 110.255 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.532 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 55.7 p-90 -145.03 -177.56 5.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 109.605 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.501 ' CD2' ' C ' ' A' ' 35' ' ' TRP . 0.8 OUTLIER -162.68 170.73 17.97 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.027 -1.045 . . . . 0.0 110.422 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.418 ' CZ2' ' HH2' ' A' ' 35' ' ' TRP . 26.3 m95 -79.37 105.23 10.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.337 -0.852 . . . . 0.0 110.033 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.588 ' O ' HG13 ' B' ' 31' ' ' VAL . 9.0 t . . . . . 0 N--CA 1.493 1.678 0 O-C-N 121.272 -0.893 . . . . 0.0 110.315 -179.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.386 0.612 . . . . 0.0 110.268 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 1.058 HG23 ' O ' ' A' ' 7' ' ' LEU . 19.1 mt -141.96 148.81 20.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.336 -0.852 . . . . 0.0 109.678 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.2 t -126.69 113.12 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.104 -0.998 . . . . 0.0 110.654 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.414 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 94.6 m -93.86 156.88 16.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 109.809 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 50' ' ' THR . 1.6 mp -137.36 139.86 41.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.565 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.568 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 0.0 OUTLIER -96.54 125.08 40.77 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.653 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.49 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 28.3 m-85 -107.79 148.71 29.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.445 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.51 -16.78 28.24 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 85.0 p -147.61 148.15 30.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.148 -0.97 . . . . 0.0 110.178 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 16.0 mt-10 -70.16 -36.97 75.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.209 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 43.2 t-105 -53.78 -48.0 70.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.296 -0.877 . . . . 0.0 109.988 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 55.2 tt0 -57.07 -36.05 70.09 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.312 -0.867 . . . . 0.0 110.53 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.444 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 1.1 ttp180 -59.62 -44.93 93.29 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.208 -0.933 . . . . 0.0 110.948 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -61.3 -40.58 94.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.111 -0.993 . . . . 0.0 111.391 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.443 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 56.7 mt-30 -65.42 -43.33 90.85 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.886 -1.134 . . . . 0.0 110.743 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.801 ' O ' HG22 ' A' ' 66' ' ' VAL . 15.9 t80 -55.96 -51.72 66.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.23 -0.919 . . . . 0.0 110.789 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 43.1 mt -59.61 -14.74 14.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.199 -0.938 . . . . 0.0 110.605 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.8 t -96.44 -21.91 17.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.897 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 4.8 mt-30 -95.85 -34.19 11.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.071 -1.018 . . . . 0.0 110.438 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.801 HG22 ' O ' ' A' ' 62' ' ' PHE . 19.5 m -87.03 109.12 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.101 -0.999 . . . . 0.0 110.624 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.3 137.33 36.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.561 HD11 HG21 ' A' ' 72' ' ' ILE . 18.2 tt -150.37 131.57 7.41 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.011 -1.055 . . . . 0.0 110.739 -179.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.626 ' HG2' HG22 ' A' ' 71' ' ' THR . 43.6 Cg_endo -47.28 -178.39 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 124.246 1.656 . . . . 0.0 111.063 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.54 6.06 45.17 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.235 -0.915 . . . . 0.0 110.377 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.862 HG23 HG12 ' A' ' 72' ' ' ILE . 9.8 t -84.21 -30.38 25.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.063 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.862 HG12 HG23 ' A' ' 71' ' ' THR . 17.3 mm -94.86 103.23 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.4 m -95.35 157.78 15.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.243 -0.911 . . . . 0.0 109.997 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.615 ' HB ' HD12 ' A' ' 7' ' ' LEU . 9.8 p -145.85 157.88 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.147 -0.971 . . . . 0.0 110.592 -179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.59 -179.13 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.452 -0.78 . . . . 0.0 110.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 p -107.4 170.46 7.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.109 -0.994 . . . . 0.0 110.79 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.427 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -164.4 -174.07 33.76 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' B' ' 78' ' ' PHE . 38.6 m-85 -148.1 142.08 25.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.223 -1.163 . . . . 0.0 110.69 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.438 ' HG3' HG21 ' A' ' 4' ' ' ILE . 90.3 mmm -122.94 156.91 33.75 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 110.042 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.415 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -135.62 102.74 5.2 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.349 -0.844 . . . . 0.0 110.146 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.415 HG23 ' C ' ' A' ' 80' ' ' SER . 14.4 pt . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.289 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.185 0.517 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.54 132.99 42.96 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 109.964 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.497 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 44.2 Cg_endo -91.8 165.9 3.29 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.923 1.486 . . . . 0.0 110.678 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.453 HG21 ' HG3' ' B' ' 79' ' ' MET . 1.4 pt -144.18 -179.92 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.354 -0.841 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.537 HG13 ' CG2' ' B' ' 74' ' ' VAL . 1.0 OUTLIER -146.59 130.94 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.119 -0.988 . . . . 0.0 110.213 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.574 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -106.06 121.69 44.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.124 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 1.043 ' O ' HG23 ' B' ' 48' ' ' ILE . 4.2 tp -119.79 139.94 51.54 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.216 -0.928 . . . . 0.0 110.1 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.508 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 9.9 ttpp -142.55 167.36 22.27 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.11 -0.994 . . . . 0.0 110.534 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.508 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 154.74 -166.34 32.34 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . 0.499 ' HB2' ' OG1' ' B' ' 13' ' ' THR . 67.2 m-20 -64.99 136.42 56.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.129 -1.218 . . . . 0.0 109.752 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.431 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.57 -45.53 57.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 111.297 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -64.38 -46.3 83.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.121 -0.987 . . . . 0.0 111.117 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.499 ' OG1' ' HB2' ' B' ' 10' ' ' ASP . 6.5 m -57.87 -31.57 66.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.026 -1.046 . . . . 0.0 110.345 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.461 HD12 ' O ' ' B' ' 10' ' ' ASP . 6.2 mt -74.93 -25.13 58.68 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.211 -0.931 . . . . 0.0 109.548 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.58 -40.31 86.98 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.438 -0.789 . . . . 0.0 110.069 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.491 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.0 t -70.21 -37.25 75.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.308 -0.87 . . . . 0.0 110.473 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 17.1 mt -58.81 -54.62 45.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.19 -0.944 . . . . 0.0 110.17 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.501 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 27.6 ttt180 -47.19 -26.19 1.1 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.494 -0.754 . . . . 0.0 110.77 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.491 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 11.1 t80 -65.03 -50.79 64.86 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.038 -1.039 . . . . 0.0 110.79 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.66 -13.39 62.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.168 -0.958 . . . . 0.0 110.539 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.501 ' HB2' ' O ' ' B' ' 18' ' ' ARG . 2.4 m-30 -66.48 -35.62 80.73 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.15 -0.969 . . . . 0.0 110.262 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -63.33 -29.87 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.188 -0.945 . . . . 0.0 110.37 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -74.85 -41.26 60.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.108 -0.995 . . . . 0.0 109.831 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.721 ' HB3' HD22 ' B' ' 27' ' ' LEU . 66.7 m-70 -95.09 37.05 1.17 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.34 -0.85 . . . . 0.0 109.861 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.611 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 7.7 p -57.07 -14.44 3.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.376 -0.827 . . . . 0.0 110.457 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 27.5 p -96.35 6.77 48.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.168 -0.957 . . . . 0.0 110.103 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.721 HD22 ' HB3' ' B' ' 24' ' ' HIS . 6.5 mp -92.54 -35.5 13.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.315 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.611 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 37.5 p90 -110.54 166.21 11.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.147 -0.971 . . . . 0.0 110.197 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.7 -30.24 12.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.296 -0.878 . . . . 0.0 110.766 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.586 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.56 114.15 2.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.13 -0.981 . . . . 0.0 110.49 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.762 ' O ' HG13 ' B' ' 31' ' ' VAL . 12.1 p -90.02 99.36 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.097 -1.002 . . . . 0.0 109.725 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.532 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -50.87 148.28 4.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.117 -0.99 . . . . 0.0 110.102 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' A' ' 35' ' ' TRP . 3.9 t -60.98 164.62 4.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.894 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.6 m -67.69 121.71 16.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.237 -0.914 . . . . 0.0 110.319 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.5 ' C ' ' CD2' ' B' ' 36' ' ' HIS . 56.6 p-90 -145.34 -177.13 5.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.149 -0.969 . . . . 0.0 109.741 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.5 ' CD2' ' C ' ' B' ' 35' ' ' TRP . 0.7 OUTLIER -162.67 170.45 18.43 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.033 -1.042 . . . . 0.0 110.41 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.428 ' CZ3' ' OG1' ' A' ' 52' ' ' THR . 26.4 m95 -79.26 104.93 10.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . 0.678 ' O ' HG13 ' A' ' 31' ' ' VAL . 8.8 t . . . . . 0 N--CA 1.49 1.564 0 O-C-N 121.297 -0.877 . . . . 0.0 110.185 -179.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.677 0 CA-C-O 121.3 0.571 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 1.043 HG23 ' O ' ' B' ' 7' ' ' LEU . 19.7 mt -141.64 149.16 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 109.704 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 93.1 t -126.91 113.28 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.112 -0.992 . . . . 0.0 110.626 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.419 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 97.7 m -94.26 156.86 16.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 109.899 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' B' ' 50' ' ' THR . 1.7 mp -137.22 139.84 41.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.045 -1.034 . . . . 0.0 110.623 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.586 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 0.0 OUTLIER -96.67 125.18 40.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.728 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.497 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 28.9 m-85 -107.99 149.08 28.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 0.0 110.528 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.84 -16.59 28.01 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.407 -0.808 . . . . 0.0 110.17 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 85.1 p -147.83 146.7 29.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.453 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 15.6 mt-10 -68.71 -37.64 79.65 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.152 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . 0.416 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 44.3 t-105 -53.7 -48.32 69.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.318 -0.864 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.491 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.5 tt0 -56.8 -35.72 69.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.408 -0.807 . . . . 0.0 110.453 -179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.462 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 1.1 ttp180 -59.83 -45.44 92.39 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.042 -1.036 . . . . 0.0 110.979 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -60.95 -40.23 92.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.163 -0.96 . . . . 0.0 111.235 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 57.4 mt-30 -65.62 -43.44 89.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.051 -1.031 . . . . 0.0 110.73 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.793 ' O ' HG22 ' B' ' 66' ' ' VAL . 17.1 t80 -55.88 -51.66 66.79 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.286 -0.884 . . . . 0.0 110.672 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.78 -15.51 20.98 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.134 -0.979 . . . . 0.0 110.765 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 10.6 t -95.49 -21.99 17.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.117 -0.989 . . . . 0.0 110.974 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 4.6 mt-30 -95.91 -33.06 12.33 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.079 -1.013 . . . . 0.0 110.545 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.793 HG22 ' O ' ' B' ' 62' ' ' PHE . 20.1 m -88.3 109.43 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.208 -0.932 . . . . 0.0 110.616 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.97 137.29 36.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.945 . . . . 0.0 109.507 179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.556 HD11 HG21 ' B' ' 72' ' ' ILE . 18.4 tt -150.3 131.68 7.5 Favored Pre-proline 0 C--N 1.305 -1.369 0 O-C-N 120.993 -1.067 . . . . 0.0 110.518 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.615 ' HG2' HG22 ' B' ' 71' ' ' THR . 42.2 Cg_endo -47.93 -179.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.711 0 O-C-N 124.148 1.604 . . . . 0.0 110.942 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -89.48 5.75 43.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.37 -0.831 . . . . 0.0 110.481 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . 0.874 HG23 HG12 ' B' ' 72' ' ' ILE . 9.4 t -84.17 -30.58 25.71 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.158 -0.964 . . . . 0.0 110.227 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.874 HG12 HG23 ' B' ' 71' ' ' THR . 16.8 mm -94.6 103.52 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -0.926 . . . . 0.0 110.254 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 63.2 m -95.41 157.39 15.92 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.237 -0.914 . . . . 0.0 110.204 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.616 ' HB ' HD12 ' B' ' 7' ' ' LEU . 9.8 p -145.64 157.49 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.059 -1.026 . . . . 0.0 110.743 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.3 -178.99 5.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.496 -0.753 . . . . 0.0 109.875 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.5 p -107.15 171.91 7.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.102 -0.999 . . . . 0.0 110.773 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.447 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -164.98 -175.1 35.4 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' A' ' 78' ' ' PHE . 36.8 m-85 -147.8 140.57 24.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -1.133 . . . . 0.0 110.462 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.453 ' HG3' HG21 ' B' ' 4' ' ' ILE . 89.6 mmm -121.99 157.53 31.12 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 110.033 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.407 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.3 OUTLIER -135.84 103.51 5.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.239 -0.913 . . . . 0.0 110.178 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.407 HG23 ' C ' ' B' ' 80' ' ' SER . 13.8 pt . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.18 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.252 0.549 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 m -72.33 123.62 89.74 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.286 -0.884 . . . . 0.0 110.256 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.562 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.7 Cg_endo -76.92 153.06 32.6 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 O-C-N 123.947 1.498 . . . . 0.0 110.296 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.653 HD11 ' HA3' ' A' ' 77' ' ' GLY . 0.8 OUTLIER -144.2 176.4 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.482 HG23 ' HB2' ' A' ' 51' ' ' LEU . 2.4 m -146.33 129.05 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.313 -0.867 . . . . 0.0 110.214 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.494 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 1.1 m170 -104.98 116.51 32.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.936 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.582 HD12 ' O ' ' A' ' 49' ' ' VAL . 1.0 OUTLIER -109.75 142.51 40.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.225 -0.922 . . . . 0.0 110.142 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.914 ' HD3' HD11 ' A' ' 48' ' ' ILE . 14.9 ttpt -141.5 166.48 24.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.261 -0.899 . . . . 0.0 110.492 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.25 -160.05 29.23 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.04 136.52 56.86 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -1.183 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.99 -29.59 8.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.301 -0.874 . . . . 0.0 110.52 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -78.01 -46.3 21.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.106 -0.996 . . . . 0.0 110.173 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.7 m -58.1 -14.08 6.09 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.389 -0.82 . . . . 0.0 110.419 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.561 ' HA ' HD12 ' A' ' 17' ' ' LEU . 16.0 mt -87.62 -38.39 15.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 110.423 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.03 -37.39 79.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.221 -0.924 . . . . 0.0 110.227 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 8.0 t -70.08 -37.29 75.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.317 -0.864 . . . . 0.0 110.558 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.599 HD11 HG13 ' A' ' 72' ' ' ILE . 19.1 mt -58.75 -48.84 79.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.079 -1.013 . . . . 0.0 110.223 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.587 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 19.5 ttm180 -47.69 -37.3 12.74 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.253 -0.905 . . . . 0.0 110.253 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 18.1 t80 -64.76 -31.25 72.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 0.0 110.627 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.451 ' NH1' ' HE3' ' A' ' 67' ' ' LYS . 6.2 mmt180 -70.42 -30.54 67.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.147 -0.971 . . . . 0.0 110.205 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.587 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.1 m-30 -66.63 -17.26 64.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.894 . . . . 0.0 110.327 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.8 mmtt -63.63 -33.0 74.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.305 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.509 ' O ' ' ND1' ' A' ' 24' ' ' HIS . 4.1 mmtp -75.03 -10.87 59.88 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.205 -0.934 . . . . 0.0 110.225 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.875 ' CB ' HD22 ' A' ' 27' ' ' LEU . 8.0 m-70 -144.7 46.32 1.37 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.215 -0.928 . . . . 0.0 109.928 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.534 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 11.3 t -57.43 -14.87 5.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.464 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -96.48 17.01 17.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.139 -0.976 . . . . 0.0 110.325 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.875 HD22 ' CB ' ' A' ' 24' ' ' HIS . 5.0 mp -92.41 -35.11 13.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.248 -0.908 . . . . 0.0 110.017 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.534 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 16.8 p90 -108.03 172.75 6.66 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.208 -0.933 . . . . 0.0 109.994 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 96.4 m -99.82 -32.05 11.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.198 -0.938 . . . . 0.0 111.372 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.75 119.89 3.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.859 -1.151 . . . . 0.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.644 ' O ' HG13 ' A' ' 31' ' ' VAL . 9.4 p -89.1 114.9 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 109.655 179.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.614 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -83.79 152.78 24.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.149 -0.969 . . . . 0.0 110.671 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.4 p -61.36 164.79 5.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.322 -0.861 . . . . 0.0 110.425 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 m -68.12 126.17 28.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.355 -0.841 . . . . 0.0 110.239 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.592 ' CZ3' ' CB ' ' B' ' 32' ' ' SER . 1.6 p-90 -145.46 164.4 31.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.042 -1.036 . . . . 0.0 109.438 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.426 ' C ' ' CD2' ' A' ' 36' ' ' HIS . 2.0 p-80 -162.45 -178.72 6.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.967 -1.083 . . . . 0.0 110.973 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.481 ' O ' ' HB ' ' A' ' 38' ' ' THR . 33.7 m95 -79.55 126.49 30.94 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.525 -0.734 . . . . 0.0 110.664 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.481 ' HB ' ' O ' ' A' ' 37' ' ' TRP . 0.6 OUTLIER . . . . . 0 N--CA 1.491 1.6 0 O-C-N 121.329 -0.857 . . . . 0.0 110.063 179.53 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.457 ' O ' HD11 ' A' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.49 1.573 0 CA-C-O 121.194 0.521 . . . . 0.0 110.156 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.914 HD11 ' HD3' ' A' ' 8' ' ' LYS . 20.0 mt -142.49 147.31 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 0.0 110.248 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.582 ' O ' HD12 ' A' ' 7' ' ' LEU . 21.3 t -125.36 119.93 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.294 -0.879 . . . . 0.0 110.234 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.494 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 16.0 m -94.22 151.86 19.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.256 -0.902 . . . . 0.0 110.132 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.482 ' HB2' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -137.08 131.73 33.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 110.07 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.473 ' HA ' HG22 ' A' ' 4' ' ' ILE . 40.2 p -97.77 136.37 38.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -0.833 . . . . 0.0 110.239 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.562 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 37.5 m-85 -116.16 153.99 30.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.0 110.125 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -89.92 -13.88 35.37 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.25 -0.907 . . . . 0.0 110.768 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.591 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 1.7 m -142.28 151.13 41.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.044 -1.035 . . . . 0.0 110.221 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -70.97 -53.9 13.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.668 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 6.9 p90 -54.03 -35.16 61.64 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.098 -1.001 . . . . 0.0 110.063 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.668 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 33.3 tt0 -56.89 -37.76 71.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 110.024 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -59.59 -40.21 86.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.658 ' HA ' HD12 ' A' ' 63' ' ' LEU . 96.5 m-20 -61.08 -40.36 93.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.329 -0.857 . . . . 0.0 110.458 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.489 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 64.4 mt-30 -65.66 -40.68 92.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.224 -0.923 . . . . 0.0 110.36 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.681 ' CE2' HG21 ' A' ' 66' ' ' VAL . 85.9 t80 -55.7 -39.81 71.54 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.108 -0.995 . . . . 0.0 109.531 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 60' ' ' ASP . 62.2 mt -58.89 -27.64 65.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.389 -0.819 . . . . 0.0 109.713 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 8.5 p -96.37 -6.21 38.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 109.794 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.517 ' CG ' HD21 ' A' ' 27' ' ' LEU . 20.0 mm-40 -95.23 -28.36 15.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.394 -0.817 . . . . 0.0 109.741 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.722 ' O ' HG23 ' A' ' 66' ' ' VAL . 33.3 m -131.26 85.47 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.324 -0.86 . . . . 0.0 109.863 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.451 ' HE3' ' NH1' ' A' ' 20' ' ' ARG . 7.4 pttp -41.85 135.82 2.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.237 -0.914 . . . . 0.0 110.423 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.487 HD12 ' O ' ' A' ' 66' ' ' VAL . 1.4 mp -88.41 148.69 42.94 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.369 -0.832 . . . . 0.0 110.126 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.527 ' CG ' ' CG1' ' A' ' 72' ' ' ILE . 46.3 Cg_endo -70.81 -160.06 0.07 OUTLIER 'Trans proline' 0 C--N 1.302 -1.872 0 O-C-N 124.163 1.612 . . . . 0.0 110.579 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.551 ' O ' HG23 ' A' ' 71' ' ' THR . 0.3 OUTLIER -104.9 24.61 11.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.551 HG23 ' O ' ' A' ' 70' ' ' LYS . 1.9 p -154.42 3.15 0.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 111.441 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.75 HD13 ' O ' ' A' ' 8' ' ' LYS . 9.6 mm -95.12 121.16 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.807 -1.183 . . . . 0.0 109.901 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.469 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 1.7 m -94.86 129.81 41.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 110.29 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.562 ' O ' HG13 ' A' ' 74' ' ' VAL . 2.9 p -112.02 100.37 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.476 -0.765 . . . . 0.0 109.822 178.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.02 175.99 5.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.746 -1.221 . . . . 0.0 110.536 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.9 p -109.06 153.26 23.9 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.025 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.653 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -162.16 178.36 38.0 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -147.84 139.14 23.58 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.269 -1.136 . . . . 0.0 110.263 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.417 ' SD ' ' CE1' ' B' ' 6' ' ' HIS . 2.1 mtm -126.01 138.21 53.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.108 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.26 101.82 6.91 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.23 -0.918 . . . . 0.0 110.336 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.19 179.879 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.244 0.545 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 3.0 m -71.96 123.76 89.91 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 110.279 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -76.97 153.21 32.47 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 123.997 1.525 . . . . 0.0 110.262 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.659 HD11 ' HA3' ' B' ' 77' ' ' GLY . 0.7 OUTLIER -144.28 176.07 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.324 -0.86 . . . . 0.0 110.245 179.822 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.467 HG23 ' HB2' ' B' ' 51' ' ' LEU . 2.5 m -146.05 128.86 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.33 -0.856 . . . . 0.0 110.179 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.469 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.1 m170 -104.57 118.57 36.92 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.255 -0.903 . . . . 0.0 109.624 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.573 HD12 ' O ' ' B' ' 49' ' ' VAL . 1.0 OUTLIER -111.69 142.37 44.11 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.426 -0.796 . . . . 0.0 110.139 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.91 ' HD3' HD11 ' B' ' 48' ' ' ILE . 15.0 ttpt -141.64 166.05 25.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.85 -160.14 29.48 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.98 136.17 56.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.279 -1.13 . . . . 0.0 110.158 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.83 -30.19 9.37 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.271 -0.893 . . . . 0.0 110.305 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -76.82 -46.76 23.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.254 -0.904 . . . . 0.0 110.223 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -57.96 -15.24 8.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.32 -0.862 . . . . 0.0 110.533 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' B' ' 17' ' ' LEU . 16.6 mt -86.4 -38.07 17.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 110.561 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.1 -37.53 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.199 -0.938 . . . . 0.0 110.325 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.471 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 8.4 t -69.93 -37.22 75.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.919 . . . . 0.0 110.344 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' B' ' 14' ' ' LEU . 19.8 mt -58.69 -49.03 79.07 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.231 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.584 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 19.1 ttm180 -47.93 -36.62 12.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.409 -0.807 . . . . 0.0 110.151 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.471 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 21.9 t80 -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.427 -0.796 . . . . 0.0 110.503 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.457 ' NH1' ' HE3' ' B' ' 67' ' ' LYS . 6.3 mmt180 -69.83 -31.05 68.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.228 -0.92 . . . . 0.0 110.33 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.584 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.2 m-30 -66.4 -17.21 64.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.199 -0.938 . . . . 0.0 110.317 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -63.46 -32.83 74.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.26 -0.9 . . . . 0.0 110.191 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . 0.507 ' O ' ' ND1' ' B' ' 24' ' ' HIS . 4.0 mmtp -75.26 -10.67 59.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.208 -0.933 . . . . 0.0 110.214 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.877 ' CB ' HD22 ' B' ' 27' ' ' LEU . 8.6 m-70 -145.06 46.46 1.33 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.229 -0.919 . . . . 0.0 109.998 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.567 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 13.9 t -57.29 -14.54 4.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.258 -0.902 . . . . 0.0 110.565 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -96.59 16.26 19.35 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.251 -0.905 . . . . 0.0 110.294 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.877 HD22 ' CB ' ' B' ' 24' ' ' HIS . 5.2 mp -92.12 -34.08 14.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 110.025 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.567 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 17.1 p90 -108.37 172.54 6.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.9 . . . . 0.0 110.048 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -99.97 -32.11 11.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.157 -0.965 . . . . 0.0 111.283 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.86 119.88 2.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.899 -1.126 . . . . 0.0 111.013 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.632 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.3 p -89.46 115.2 28.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.277 -0.889 . . . . 0.0 109.567 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.592 ' CB ' ' CZ3' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -83.92 153.34 24.01 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.204 -0.935 . . . . 0.0 110.74 -179.417 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 60.3 p -61.56 164.44 5.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.328 -0.858 . . . . 0.0 110.314 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -68.05 126.45 29.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.287 -0.883 . . . . 0.0 110.25 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.614 ' CZ3' ' CB ' ' A' ' 32' ' ' SER . 1.7 p-90 -145.71 164.93 30.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.014 -1.054 . . . . 0.0 109.567 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.417 ' CD2' ' C ' ' B' ' 36' ' ' HIS . 2.0 p-80 -162.46 -177.91 5.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.951 -1.093 . . . . 0.0 110.972 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.496 ' O ' ' HB ' ' B' ' 38' ' ' THR . 34.1 m95 -79.87 127.0 31.72 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.415 -0.803 . . . . 0.0 110.507 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . 0.567 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.663 0 O-C-N 121.271 -0.893 . . . . 0.0 110.167 179.492 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.47 ' O ' HD11 ' B' ' 14' ' ' LEU . . . . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.159 0.504 . . . . 0.0 110.191 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.91 HD11 ' HD3' ' B' ' 8' ' ' LYS . 20.1 mt -142.48 146.84 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.274 -0.891 . . . . 0.0 110.318 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . 0.573 ' O ' HD12 ' B' ' 7' ' ' LEU . 21.4 t -124.65 120.31 58.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.469 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 16.7 m -94.35 151.22 19.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.073 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.477 HD23 ' HB2' ' B' ' 28' ' ' TYR . 0.2 OUTLIER -136.83 131.76 33.7 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.927 . . . . 0.0 110.165 179.709 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.445 ' HA ' HG22 ' B' ' 4' ' ' ILE . 40.8 p -98.01 136.2 38.62 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.368 -0.833 . . . . 0.0 110.364 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.561 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 37.6 m-85 -116.18 154.13 30.6 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 110.147 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -90.07 -14.38 33.92 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.175 -0.953 . . . . 0.0 110.736 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . 0.607 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 1.7 m -141.39 151.73 43.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.105 -0.997 . . . . 0.0 110.21 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -71.92 -53.55 12.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.23 -0.919 . . . . 0.0 110.37 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . 0.67 ' CD1' ' N ' ' B' ' 58' ' ' GLN . 6.3 p90 -53.92 -34.84 60.74 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.109 -0.995 . . . . 0.0 109.945 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.67 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 32.5 tt0 -57.0 -38.31 72.91 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.08 -1.012 . . . . 0.0 110.033 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -59.48 -39.71 84.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.226 -0.921 . . . . 0.0 109.927 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.637 ' HA ' HD12 ' B' ' 63' ' ' LEU . 96.6 m-20 -61.31 -39.97 92.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.317 -0.865 . . . . 0.0 110.216 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 65.3 mt-30 -65.85 -41.31 91.87 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.475 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.658 ' CE2' HG21 ' B' ' 66' ' ' VAL . 85.8 t80 -55.62 -39.5 70.89 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.196 -0.94 . . . . 0.0 109.53 179.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.637 HD12 ' HA ' ' B' ' 60' ' ' ASP . 67.1 mt -58.89 -27.25 65.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.472 -0.767 . . . . 0.0 109.827 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.433 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 6.5 p -96.95 -6.11 36.32 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.368 -0.832 . . . . 0.0 109.92 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . 0.514 ' CG ' HD21 ' B' ' 27' ' ' LEU . 19.5 mm-40 -95.13 -29.01 14.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.33 -0.856 . . . . 0.0 109.659 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.729 HG23 ' O ' ' B' ' 66' ' ' VAL . 33.1 m -130.55 86.69 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.443 -0.786 . . . . 0.0 109.79 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.457 ' HE3' ' NH1' ' B' ' 20' ' ' ARG . 6.9 pttp -43.15 136.18 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.242 -0.911 . . . . 0.0 110.278 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.472 HD12 ' O ' ' B' ' 66' ' ' VAL . 1.4 mp -88.49 148.61 42.58 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.24 -0.912 . . . . 0.0 109.992 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.539 ' HG2' ' CG1' ' B' ' 72' ' ' ILE . 45.0 Cg_endo -71.0 -160.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.1 1.579 . . . . 0.0 110.553 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.554 ' O ' HG23 ' B' ' 71' ' ' THR . 0.4 OUTLIER -104.43 24.77 11.1 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.136 -0.978 . . . . 0.0 110.44 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . 0.554 HG23 ' O ' ' B' ' 70' ' ' LYS . 2.1 p -154.49 3.67 0.24 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.15 -0.969 . . . . 0.0 111.397 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.765 HD13 ' O ' ' B' ' 8' ' ' LYS . 9.8 mm -95.48 121.49 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.774 -1.204 . . . . 0.0 109.917 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . 0.46 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 1.6 m -95.28 129.61 42.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.202 -0.936 . . . . 0.0 110.394 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.54 HG13 ' O ' ' B' ' 74' ' ' VAL . 2.6 p -111.65 99.86 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.497 -0.752 . . . . 0.0 109.803 178.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.92 174.86 5.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.656 -1.278 . . . . 0.0 110.424 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.1 p -107.8 152.93 23.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.402 -0.811 . . . . 0.0 110.149 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.659 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -161.45 178.49 37.34 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -147.97 139.39 23.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.25 -1.147 . . . . 0.0 110.256 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.0 mtm -126.36 139.14 53.52 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.13 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.89 101.71 6.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.411 ' OXT' HG22 ' B' ' 81' ' ' ILE . 4.1 mt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.07 -0.966 . . . . 0.0 110.207 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.458 ' HB3' ' HB3' ' A' ' 78' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.297 0.57 . . . . 0.0 110.138 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.456 ' O ' HG23 ' A' ' 4' ' ' ILE . 66.8 p -96.23 106.68 30.4 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.384 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.415 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 48.5 Cg_endo -52.82 155.7 10.42 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 O-C-N 124.034 1.544 . . . . 0.0 110.315 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.456 HG23 ' O ' ' A' ' 2' ' ' THR . 7.1 pt -143.47 178.69 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.663 HG13 ' CG1' ' A' ' 74' ' ' VAL . 40.3 t -145.53 136.04 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.281 -0.887 . . . . 0.0 110.381 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.558 ' O ' HG22 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.54 121.4 43.88 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.329 -0.857 . . . . 0.0 109.795 179.647 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.637 HD12 HG12 ' A' ' 5' ' ' VAL . 0.4 OUTLIER -115.51 123.81 49.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.546 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.622 ' HD2' HD11 ' A' ' 48' ' ' ILE . 18.8 tttt -141.48 166.22 25.35 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.236 -0.915 . . . . 0.0 110.209 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.531 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 141.88 -146.07 16.87 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.92 121.38 14.51 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.322 -1.105 . . . . 0.0 110.332 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.18 -35.96 28.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.354 -0.841 . . . . 0.0 110.733 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -75.01 -43.79 51.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.154 -0.966 . . . . 0.0 110.64 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 47.6 m -57.86 -27.01 62.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.206 -0.934 . . . . 0.0 110.507 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.769 ' HA ' HD12 ' A' ' 17' ' ' LEU . 15.7 mt -82.67 -34.45 27.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -59.78 -39.12 83.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 110.117 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.505 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 35.9 t -70.21 -37.84 75.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.407 -0.808 . . . . 0.0 110.571 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.769 HD12 ' HA ' ' A' ' 14' ' ' LEU . 22.7 mt -58.66 -50.56 73.41 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.086 -1.009 . . . . 0.0 110.166 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.408 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 18.1 ttm105 -46.98 -29.15 1.91 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.367 -0.833 . . . . 0.0 110.307 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 72.0 t80 -64.81 -42.12 95.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.234 -0.916 . . . . 0.0 110.503 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 mtt-85 -70.99 -26.24 63.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.926 . . . . 0.0 110.157 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.1 m-30 -66.55 -20.37 66.0 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.217 -0.927 . . . . 0.0 110.398 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -63.29 -27.7 69.51 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.224 -0.923 . . . . 0.0 110.42 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.6 mmtm -75.13 -48.4 23.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.476 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.431 ' CB ' HD12 ' A' ' 27' ' ' LEU . 20.1 m-70 -94.84 52.85 1.53 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.204 -0.935 . . . . 0.0 110.228 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.4 p -57.7 -13.65 4.38 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.154 -0.966 . . . . 0.0 110.742 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.86 13.4 28.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.025 -1.047 . . . . 0.0 110.699 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.769 HD11 ' NE2' ' A' ' 65' ' ' GLN . 3.6 mt -92.06 -45.11 8.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.122 -0.986 . . . . 0.0 110.089 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.769 ' CE2' HG23 ' A' ' 31' ' ' VAL . 28.6 p90 -106.12 172.66 6.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.328 -0.857 . . . . 0.0 109.584 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -100.41 -35.52 9.54 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.864 -1.148 . . . . 0.0 110.99 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 119.84 2.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.091 -1.006 . . . . 0.0 110.81 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.769 HG23 ' CE2' ' A' ' 28' ' ' TYR . 47.1 t -88.42 99.96 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.309 -0.869 . . . . 0.0 110.18 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.775 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -62.12 151.28 36.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 111.663 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.542 ' O ' HG23 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -61.69 159.1 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.441 -0.787 . . . . 0.0 109.761 179.023 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.2 127.6 33.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.773 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 58.6 p-90 -146.39 120.63 9.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.085 -1.009 . . . . 0.0 110.634 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.631 ' CD2' ' N ' ' A' ' 37' ' ' TRP . 20.2 t60 -78.94 166.44 22.38 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.032 -1.043 . . . . 0.0 109.913 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.631 ' N ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -78.41 50.7 0.96 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.445 ' C ' ' O ' ' B' ' 31' ' ' VAL . 13.0 t . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.149 179.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.231 0.538 . . . . 0.0 110.567 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.622 HD11 ' HD2' ' A' ' 8' ' ' LYS . 80.1 mt -142.27 133.75 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.22 -0.925 . . . . 0.0 110.068 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -125.14 -179.38 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.9 -1.125 . . . . 0.0 110.308 -179.932 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.415 ' N ' HG13 ' A' ' 49' ' ' VAL . 16.8 m -145.06 158.2 43.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.409 -0.807 . . . . 0.0 109.818 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 31' ' ' VAL . 27.0 mt -135.04 131.52 37.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.231 -0.918 . . . . 0.0 110.009 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.463 HG23 ' CZ2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.83 130.56 44.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 110.263 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.415 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 35.0 m-85 -117.8 152.86 34.48 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.387 -0.82 . . . . 0.0 109.986 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -95.48 -18.35 20.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.362 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 77.3 p -145.43 140.44 27.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -61.12 -39.58 90.55 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 0.0 110.226 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.9 t-105 -53.96 -50.45 66.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.286 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.423 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 60.2 tt0 -57.27 -40.1 77.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.424 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -59.32 -38.99 81.7 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.128 -0.983 . . . . 0.0 110.168 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.833 ' HA ' HD12 ' A' ' 63' ' ' LEU . 42.6 m-20 -61.34 -41.42 97.01 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.865 . . . . 0.0 110.53 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.454 ' O ' ' OG ' ' A' ' 64' ' ' SER . 50.2 mt-30 -65.7 -40.08 91.91 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.159 -0.963 . . . . 0.0 110.201 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.775 ' O ' HG22 ' A' ' 66' ' ' VAL . 68.3 t80 -55.76 -42.07 74.92 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.263 -0.898 . . . . 0.0 109.942 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.833 HD12 ' HA ' ' A' ' 60' ' ' ASP . 12.0 mt -59.44 -24.0 63.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.454 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 3.7 p -100.08 -7.89 24.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 110.179 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.769 ' NE2' HD11 ' A' ' 27' ' ' LEU . 3.6 mt-30 -97.07 -29.31 13.7 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.314 -0.867 . . . . 0.0 109.818 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.784 ' O ' HG23 ' A' ' 66' ' ' VAL . 19.1 m -110.04 85.36 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.644 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -35.59 104.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.557 -0.715 . . . . 0.0 110.479 -179.517 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 66' ' ' VAL . 82.3 mt -87.67 115.03 61.61 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.176 -0.953 . . . . 0.0 110.467 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -63.4 -158.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 124.073 1.565 . . . . 0.0 110.082 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -106.54 -13.1 15.42 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.108 -0.995 . . . . 0.0 110.328 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.2 p -84.59 -21.97 30.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.639 HD12 HD21 ' A' ' 14' ' ' LEU . 25.1 mm -93.75 108.34 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.285 -0.884 . . . . 0.0 109.858 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.7 m -96.14 153.72 17.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.192 -0.943 . . . . 0.0 110.241 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.663 ' CG1' HG13 ' A' ' 5' ' ' VAL . 6.9 t -145.26 156.17 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.228 -0.92 . . . . 0.0 110.717 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -138.42 -179.07 5.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.51 -0.744 . . . . 0.0 110.061 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' B' ' 80' ' ' SER . 1.6 p -106.31 154.54 20.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.201 -0.937 . . . . 0.0 110.467 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.433 ' C ' HG12 ' A' ' 4' ' ' ILE . . . -161.13 175.3 37.78 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.458 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 79.7 m-85 -147.92 137.88 22.68 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.182 -1.187 . . . . 0.0 110.44 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 7.9 mtt -115.14 162.2 17.37 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.342 -0.849 . . . . 0.0 109.814 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.444 ' O ' HG23 ' A' ' 81' ' ' ILE . 12.4 t -118.66 99.37 6.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.23 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.444 HG23 ' O ' ' A' ' 80' ' ' SER . 1.7 pt . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.248 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.448 ' HB3' ' HB3' ' B' ' 78' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.213 0.53 . . . . 0.0 110.224 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . 0.457 ' O ' HG23 ' B' ' 4' ' ' ILE . 63.6 p -96.77 106.5 30.72 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.204 -0.935 . . . . 0.0 110.308 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.424 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 48.4 Cg_endo -52.54 155.96 9.3 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.021 1.538 . . . . 0.0 110.302 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.457 HG23 ' O ' ' B' ' 2' ' ' THR . 7.6 pt -143.4 178.48 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.203 -0.936 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.665 HG13 ' CG1' ' B' ' 74' ' ' VAL . 39.8 t -145.64 136.04 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.878 . . . . 0.0 110.257 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.556 ' O ' HG22 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.94 121.1 43.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.365 -0.834 . . . . 0.0 109.783 179.857 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.625 HD12 HG12 ' B' ' 5' ' ' VAL . 0.5 OUTLIER -115.08 124.23 51.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.57 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.601 ' HD2' HD11 ' B' ' 48' ' ' ILE . 18.8 tttt -141.38 166.08 25.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -0.879 . . . . 0.0 110.196 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.53 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 142.04 -146.3 17.21 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.68 121.85 15.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.346 -1.091 . . . . 0.0 110.324 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.71 -35.49 31.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 110.725 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -75.42 -43.59 49.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.175 -0.953 . . . . 0.0 110.561 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 44.4 m -57.86 -28.18 63.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.173 -0.954 . . . . 0.0 110.403 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.76 ' HA ' HD12 ' B' ' 17' ' ' LEU . 13.0 mt -81.9 -34.66 29.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.077 -1.015 . . . . 0.0 110.117 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -59.74 -38.85 82.88 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.326 -0.859 . . . . 0.0 110.171 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.503 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 36.3 t -70.2 -37.71 75.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 0.0 110.485 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.76 HD12 ' HA ' ' B' ' 14' ' ' LEU . 23.0 mt -58.76 -50.61 73.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.142 -0.974 . . . . 0.0 110.107 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -47.16 -28.65 1.91 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.433 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.503 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 72.0 t80 -64.84 -41.92 95.34 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.317 -0.864 . . . . 0.0 110.469 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 26.2 mtt-85 -71.27 -26.42 62.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.0 110.364 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.552 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.5 m-30 -66.64 -20.17 65.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.27 -0.894 . . . . 0.0 110.359 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -63.38 -27.44 69.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.139 -0.976 . . . . 0.0 110.459 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -75.16 -48.32 24.18 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.264 -0.898 . . . . 0.0 110.512 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.423 ' CB ' HD12 ' B' ' 27' ' ' LEU . 18.9 m-70 -94.93 52.88 1.51 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.249 -0.907 . . . . 0.0 110.22 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 p -57.47 -13.72 3.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.29 -0.881 . . . . 0.0 110.558 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.96 13.58 28.42 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.128 -0.982 . . . . 0.0 110.817 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.789 HD11 ' NE2' ' B' ' 65' ' ' GLN . 3.6 mt -92.32 -44.13 8.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.071 -1.018 . . . . 0.0 109.97 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.774 ' CE2' HG23 ' B' ' 31' ' ' VAL . 27.8 p90 -107.14 173.33 6.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.256 -0.903 . . . . 0.0 109.536 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.2 m -100.86 -35.79 9.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.054 -1.029 . . . . 0.0 110.919 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.76 119.86 2.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.165 -0.959 . . . . 0.0 110.684 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.774 HG23 ' CE2' ' B' ' 28' ' ' TYR . 48.5 t -88.19 99.68 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.089 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.773 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -60.78 150.13 33.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 111.485 -179.49 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . 0.576 ' O ' HG23 ' B' ' 49' ' ' VAL . 0.3 OUTLIER -61.7 159.65 13.1 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.551 -0.718 . . . . 0.0 109.575 179.107 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.405 ' HA ' HG23 ' B' ' 49' ' ' VAL . 0.5 OUTLIER -68.25 127.41 32.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.036 -1.04 . . . . 0.0 110.616 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.775 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 58.4 p-90 -146.22 120.73 9.72 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.024 -1.047 . . . . 0.0 110.701 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.636 ' CD2' ' N ' ' B' ' 37' ' ' TRP . 20.9 t60 -78.86 166.48 22.38 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.933 -1.104 . . . . 0.0 109.902 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.636 ' N ' ' CD2' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -78.57 50.93 1.01 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.102 -0.998 . . . . 0.0 110.129 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 31' ' ' VAL . 13.6 t . . . . . 0 N--CA 1.492 1.646 0 O-C-N 121.32 -0.863 . . . . 0.0 110.184 179.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.321 0.581 . . . . 0.0 110.583 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.601 HD11 ' HD2' ' B' ' 8' ' ' LYS . 85.3 mt -142.38 134.23 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.326 -0.859 . . . . 0.0 109.799 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . 0.576 HG23 ' O ' ' B' ' 33' ' ' SER . 0.3 OUTLIER -125.91 -179.4 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.841 -1.162 . . . . 0.0 110.306 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.401 ' N ' HG13 ' B' ' 49' ' ' VAL . 17.1 m -145.03 158.43 43.82 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.318 -0.863 . . . . 0.0 109.97 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' B' ' 31' ' ' VAL . 25.2 mt -134.97 131.44 37.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.23 -0.919 . . . . 0.0 109.982 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.569 HG23 ' CZ2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.62 130.77 43.76 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.313 -0.867 . . . . 0.0 110.167 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.424 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 35.5 m-85 -118.07 153.3 33.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.346 -0.846 . . . . 0.0 110.003 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -95.4 -18.49 20.69 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.25 -0.906 . . . . 0.0 110.397 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 p -145.32 140.33 27.66 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.152 -0.967 . . . . 0.0 110.307 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.1 -39.3 89.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.288 -0.883 . . . . 0.0 110.044 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -54.12 -50.99 65.64 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.232 -0.917 . . . . 0.0 110.237 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.425 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 60.9 tt0 -57.08 -39.7 75.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.409 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -59.69 -38.86 82.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.085 -1.009 . . . . 0.0 110.006 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.859 ' HA ' HD12 ' B' ' 63' ' ' LEU . 43.4 m-20 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.416 -0.803 . . . . 0.0 110.441 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.448 ' O ' ' OG ' ' B' ' 64' ' ' SER . 52.0 mt-30 -65.83 -40.0 91.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.252 -0.905 . . . . 0.0 110.283 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.798 ' O ' HG22 ' B' ' 66' ' ' VAL . 69.5 t80 -55.83 -41.68 74.6 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 109.754 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.859 HD12 ' HA ' ' B' ' 60' ' ' ASP . 13.0 mt -59.51 -24.58 63.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.336 -0.852 . . . . 0.0 110.049 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.448 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 3.9 p -99.87 -7.9 24.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.299 -0.876 . . . . 0.0 110.144 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . 0.789 ' NE2' HD11 ' B' ' 27' ' ' LEU . 3.5 mt-30 -97.08 -29.13 13.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.303 -0.873 . . . . 0.0 109.881 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.798 HG22 ' O ' ' B' ' 62' ' ' PHE . 20.3 m -110.0 83.58 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.323 -0.861 . . . . 0.0 109.912 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.55 ' O ' ' CG ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -33.47 104.14 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.497 -0.752 . . . . 0.0 110.627 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.508 HG13 ' O ' ' B' ' 66' ' ' VAL . 84.8 mt -87.89 114.49 59.38 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 110.534 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.75 -159.03 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.845 0 O-C-N 124.211 1.637 . . . . 0.0 110.236 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -106.24 -12.84 15.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.184 -0.948 . . . . 0.0 110.492 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 29.9 p -84.69 -21.97 29.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.161 -0.962 . . . . 0.0 110.13 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.641 HD12 HD21 ' B' ' 14' ' ' LEU . 24.8 mm -94.12 108.5 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.287 -0.883 . . . . 0.0 109.751 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -96.09 153.64 17.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.109 -0.995 . . . . 0.0 110.07 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.665 ' CG1' HG13 ' B' ' 5' ' ' VAL . 6.0 t -144.99 155.98 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.107 -0.995 . . . . 0.0 110.546 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 3.3 t -138.6 -178.92 5.52 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.154 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -106.15 154.04 21.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.306 -0.871 . . . . 0.0 110.592 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.448 ' C ' HG12 ' B' ' 4' ' ' ILE . . . -160.75 174.91 37.47 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.448 ' HB3' ' HB3' ' B' ' 1' ' ' MET . 80.1 m-85 -147.99 138.07 22.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.212 -1.169 . . . . 0.0 110.416 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 7.7 mtt -115.3 161.69 18.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.208 -0.933 . . . . 0.0 109.935 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.467 ' HB3' ' O ' ' A' ' 76' ' ' THR . 13.1 t -118.37 98.95 6.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.184 -0.948 . . . . 0.0 110.168 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.445 HG23 ' O ' ' B' ' 80' ' ' SER . 1.6 pt . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.069 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 mtp . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.253 0.549 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.658 ' O ' HG23 ' A' ' 2' ' ' THR . 5.5 t -100.95 103.83 27.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.274 -0.891 . . . . 0.0 110.419 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 48.8 Cg_endo -49.33 157.94 1.83 Allowed 'Trans proline' 0 C--N 1.305 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.238 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.698 ' O ' HD12 ' A' ' 4' ' ' ILE . 2.3 pp -143.91 119.02 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.131 -0.981 . . . . 0.0 110.488 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.455 HG13 ' CG2' ' A' ' 74' ' ' VAL . 1.2 t -94.08 136.57 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.226 -0.921 . . . . 0.0 110.257 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.47 138.62 41.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.301 -0.874 . . . . 0.0 109.695 179.529 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.584 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.3 OUTLIER -129.57 131.13 46.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.958 -1.089 . . . . 0.0 110.569 -179.55 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 14.4 ttpp -141.52 167.02 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.29 -0.881 . . . . 0.0 109.951 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.432 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 145.6 -151.06 23.31 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.781 -1.327 . . . . 0.0 109.781 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 13' ' ' THR . 8.3 m-20 -65.33 127.22 30.88 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.317 -1.108 . . . . 0.0 110.715 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.62 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.32 -68.81 0.14 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 0.0 110.398 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -46.0 -43.61 14.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 110.177 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.485 HG22 HD11 ' A' ' 72' ' ' ILE . 22.3 m -57.94 -18.25 22.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 110.104 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.947 ' HA ' HD12 ' A' ' 17' ' ' LEU . 19.7 mt -91.53 -29.88 16.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.306 -0.871 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.0 mmtt -59.03 -41.43 87.77 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.204 -0.935 . . . . 0.0 110.481 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 t -69.74 -36.49 75.89 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.381 -0.824 . . . . 0.0 110.547 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.947 HD12 ' HA ' ' A' ' 14' ' ' LEU . 46.0 mt -58.92 -54.49 46.55 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.04 -1.038 . . . . 0.0 110.36 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -45.81 -32.1 2.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.307 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.82 -29.34 70.29 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.215 -0.928 . . . . 0.0 110.213 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -69.87 -21.8 63.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.025 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.708 ' CE2' HD21 ' A' ' 51' ' ' LEU . 10.2 m-30 -66.47 -36.41 82.68 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 110.045 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -63.61 -33.79 76.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.429 -0.795 . . . . 0.0 110.218 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -74.96 -9.43 58.53 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.207 -0.933 . . . . 0.0 109.863 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.551 ' HB3' HD12 ' A' ' 27' ' ' LEU . 99.1 m-70 -145.04 43.53 1.33 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.831 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.485 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.8 t -57.74 -8.58 0.95 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.421 -0.8 . . . . 0.0 111.039 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.6 p -95.78 7.69 45.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.93 -1.106 . . . . 0.0 110.292 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.551 HD12 ' HB3' ' A' ' 24' ' ' HIS . 5.0 mt -92.33 -54.87 3.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 0.0 109.864 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.639 ' CD1' HG13 ' A' ' 31' ' ' VAL . 31.7 p90 -93.65 169.84 10.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.1 m -100.61 -33.24 10.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.081 -1.012 . . . . 0.0 110.811 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.49 114.7 2.44 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.959 -1.088 . . . . 0.0 110.748 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.68 HG12 ' CD2' ' A' ' 51' ' ' LEU . 20.5 m -90.57 112.9 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 110.187 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.568 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -68.45 147.94 51.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.157 -0.964 . . . . 0.0 110.342 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -61.5 159.64 12.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.895 ' HA ' HG23 ' A' ' 49' ' ' VAL . 91.7 m -68.18 134.86 51.16 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.356 -0.84 . . . . 0.0 110.447 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.59 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 60.2 p-90 -146.66 -178.39 6.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 0.0 109.564 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.576 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 70.6 t60 -162.43 174.23 13.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.893 -1.129 . . . . 0.0 110.66 -179.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 74.7 m95 -78.65 103.41 8.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.274 -0.891 . . . . 0.0 110.281 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.448 ' O ' HG23 ' B' ' 31' ' ' VAL . 3.0 p . . . . . 0 N--CA 1.49 1.562 0 O-C-N 121.349 -0.844 . . . . 0.0 110.217 179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.49 1.565 0 CA-C-O 121.373 0.606 . . . . 0.0 110.567 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.584 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.9 mt -143.85 148.48 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.41 -0.806 . . . . 0.0 109.939 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.895 HG23 ' HA ' ' A' ' 34' ' ' THR . 0.4 OUTLIER -128.16 -179.48 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.1 -1.0 . . . . 0.0 110.276 -179.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.566 ' N ' HG13 ' A' ' 49' ' ' VAL . 96.4 m -145.98 154.05 41.47 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.256 -0.903 . . . . 0.0 110.009 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.708 HD21 ' CE2' ' A' ' 21' ' ' PHE . 17.7 mt -132.91 124.09 27.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.148 -0.97 . . . . 0.0 110.24 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 132.88 42.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.28 -0.887 . . . . 0.0 110.263 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 45.0 m-85 -117.73 153.87 32.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -0.876 . . . . 0.0 110.188 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -85.25 -9.99 57.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 110.574 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -162.46 160.43 26.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.135 -0.978 . . . . 0.0 110.238 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -70.99 -37.85 72.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.18 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -53.97 -52.38 60.87 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 21.5 tt0 -58.08 -36.03 72.26 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.335 -0.853 . . . . 0.0 110.624 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp85 -59.13 -54.13 50.46 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.101 -0.999 . . . . 0.0 110.601 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.551 ' HA ' HD12 ' A' ' 63' ' ' LEU . 2.2 t70 -61.05 -26.34 67.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.201 -0.937 . . . . 0.0 110.364 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 46.7 mt-30 -65.54 -54.89 21.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 109.785 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 1.067 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.8 t80 -55.63 -39.74 71.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.905 . . . . 0.0 109.832 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 60' ' ' ASP . 9.2 mt -59.19 -23.64 62.42 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 110.068 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.71 -18.69 21.06 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.31 -0.869 . . . . 0.0 110.149 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -93.93 -9.05 38.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.178 -0.951 . . . . 0.0 109.89 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 1.067 HG22 ' O ' ' A' ' 62' ' ' PHE . 34.0 m -136.41 133.09 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.367 -0.833 . . . . 0.0 109.811 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 103.08 11.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.241 -0.912 . . . . 0.0 109.785 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.722 ' CG2' HD12 ' A' ' 72' ' ' ILE . 18.1 mt -88.08 130.94 44.4 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.437 -0.789 . . . . 0.0 110.336 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.55 ' HD2' ' CG2' ' A' ' 68' ' ' ILE . 41.6 Cg_endo -40.53 162.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.639 0 O-C-N 123.969 1.51 . . . . 0.0 110.463 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -74.99 3.35 8.5 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.298 -0.876 . . . . 0.0 110.882 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -24.87 28.79 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.043 -1.035 . . . . 0.0 109.842 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.722 HD12 ' CG2' ' A' ' 68' ' ' ILE . 81.2 mt -95.41 109.11 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.51 -0.743 . . . . 0.0 110.503 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 79.4 m -96.14 157.0 16.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.219 -0.926 . . . . 0.0 110.451 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 6' ' ' HIS . 3.4 p -143.07 136.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.106 -0.996 . . . . 0.0 111.409 -179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.23 -179.53 4.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.294 0.568 . . . . 0.0 110.141 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 50.2 p -128.94 154.33 46.66 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.306 -0.871 . . . . 0.0 109.96 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -171.54 -170.33 35.46 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.414 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 56.2 m-85 -147.53 150.63 34.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.355 -1.085 . . . . 0.0 110.32 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 1.1 ttt -124.61 167.61 14.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.235 -0.915 . . . . 0.0 109.989 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 27.4 t -131.47 103.68 6.56 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.0 110.309 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.603 ' O ' HG23 ' A' ' 81' ' ' ILE . 6.5 tt . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.257 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 mtp . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.247 0.546 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . 0.652 ' O ' HG23 ' B' ' 2' ' ' THR . 5.4 t -101.31 104.46 33.47 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 110.401 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.525 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -50.16 157.63 2.86 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 123.974 1.513 . . . . 0.0 110.114 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.683 ' O ' HD12 ' B' ' 4' ' ' ILE . 2.3 pp -143.87 119.05 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.217 -0.927 . . . . 0.0 110.325 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.437 HG13 ' CG2' ' B' ' 74' ' ' VAL . 1.1 t -94.11 136.11 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.262 -0.899 . . . . 0.0 110.301 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.503 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.2 138.57 41.19 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.29 -0.881 . . . . 0.0 109.666 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.608 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.3 OUTLIER -129.77 131.4 46.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.004 -1.06 . . . . 0.0 110.607 -179.484 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 15.0 ttpp -141.43 167.17 22.8 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.983 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.43 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 145.66 -151.53 23.72 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . 0.411 ' O ' ' HB ' ' B' ' 13' ' ' THR . 9.6 m-20 -64.93 127.25 30.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.275 -1.132 . . . . 0.0 110.655 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.635 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.34 -68.99 0.13 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.275 -0.89 . . . . 0.0 110.282 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . 0.411 ' OD1' ' N ' ' B' ' 13' ' ' THR . 10.3 p30 -45.71 -43.93 13.2 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.496 HG22 HD11 ' B' ' 72' ' ' ILE . 22.2 m -57.83 -18.02 19.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.289 -0.882 . . . . 0.0 110.096 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.946 ' HA ' HD12 ' B' ' 17' ' ' LEU . 18.6 mt -91.74 -29.63 16.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.254 -0.904 . . . . 0.0 110.337 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.5 mmtt -59.17 -41.17 87.8 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.331 -0.856 . . . . 0.0 110.519 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 15.8 t -69.96 -36.56 75.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.368 -0.832 . . . . 0.0 110.564 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.946 HD12 ' HA ' ' B' ' 14' ' ' LEU . 44.4 mt -59.04 -54.12 50.68 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.115 -0.991 . . . . 0.0 110.495 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -46.08 -31.99 2.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.838 . . . . 0.0 110.332 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.89 -29.85 70.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.161 -0.962 . . . . 0.0 110.081 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -69.6 -21.95 63.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.262 -0.899 . . . . 0.0 110.008 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.7 ' CE2' HD21 ' B' ' 51' ' ' LEU . 10.2 m-30 -66.48 -36.3 82.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.87 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -63.71 -34.0 76.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.377 -0.827 . . . . 0.0 110.222 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -74.88 -9.3 58.41 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.161 -0.962 . . . . 0.0 109.753 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.535 ' HB3' HD12 ' B' ' 27' ' ' LEU . 99.0 m-70 -145.16 43.66 1.32 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.379 -0.826 . . . . 0.0 109.948 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.467 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.8 t -57.73 -8.9 1.02 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.341 -0.849 . . . . 0.0 111.136 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 68.9 p -95.38 7.62 45.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.959 -1.088 . . . . 0.0 110.327 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.535 HD12 ' HB3' ' B' ' 24' ' ' HIS . 5.0 mt -92.41 -54.49 3.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.878 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.65 ' CD1' HG13 ' B' ' 31' ' ' VAL . 31.6 p90 -93.7 169.46 10.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.273 -0.892 . . . . 0.0 109.779 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 5.5 m -100.53 -33.15 10.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.116 -0.99 . . . . 0.0 110.815 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.44 114.55 2.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.1 -1.0 . . . . 0.0 110.843 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.688 HG12 ' CD2' ' B' ' 51' ' ' LEU . 17.0 m -90.6 111.63 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.405 -0.809 . . . . 0.0 110.119 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.59 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -67.6 148.33 51.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.11 -0.994 . . . . 0.0 110.502 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -61.6 158.96 14.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.344 -0.847 . . . . 0.0 110.245 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.883 ' HA ' HG23 ' B' ' 49' ' ' VAL . 86.1 m -68.18 134.9 51.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.317 -0.864 . . . . 0.0 110.602 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.568 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 59.5 p-90 -146.75 -178.17 6.04 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 109.549 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.583 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 70.4 t60 -162.35 174.44 12.79 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.828 -1.17 . . . . 0.0 110.685 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.583 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 73.5 m95 -78.54 103.57 8.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.183 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 31' ' ' VAL . 3.0 p . . . . . 0 N--CA 1.492 1.649 0 O-C-N 121.268 -0.895 . . . . 0.0 110.167 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.519 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.491 1.62 0 CA-C-O 121.444 0.64 . . . . 0.0 110.44 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.608 HG23 ' O ' ' B' ' 7' ' ' LEU . 44.5 mt -143.93 148.22 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 0.0 110.024 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . 0.883 HG23 ' HA ' ' B' ' 34' ' ' THR . 0.4 OUTLIER -127.47 -179.33 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.134 -0.979 . . . . 0.0 110.193 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.585 ' N ' HG13 ' B' ' 49' ' ' VAL . 93.4 m -145.73 154.27 41.87 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.7 HD21 ' CE2' ' B' ' 21' ' ' PHE . 18.9 mt -133.14 123.53 25.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.052 -1.03 . . . . 0.0 110.207 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.12 133.69 41.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 110.201 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.525 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 44.2 m-85 -118.91 154.41 33.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.275 -0.891 . . . . 0.0 110.226 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.09 -10.66 56.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 0.0 110.522 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -162.16 160.71 27.51 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.08 -1.012 . . . . 0.0 110.434 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 78.5 mt-10 -70.72 -38.81 73.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.238 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -53.63 -52.18 60.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 110.229 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.482 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 21.9 tt0 -58.25 -35.93 72.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.602 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 13.2 ttp85 -59.19 -54.33 48.21 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.054 -1.028 . . . . 0.0 110.68 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.538 ' HA ' HD12 ' B' ' 63' ' ' LEU . 2.5 t70 -61.0 -26.1 67.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 110.295 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 45.3 mt-30 -65.54 -54.89 21.64 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.22 -0.925 . . . . 0.0 109.915 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 1.046 ' O ' HG22 ' B' ' 66' ' ' VAL . 1.7 t80 -55.67 -39.95 71.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.833 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' B' ' 60' ' ' ASP . 9.0 mt -59.19 -23.61 62.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.3 -0.875 . . . . 0.0 110.044 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.22 -18.95 21.18 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.217 -0.927 . . . . 0.0 110.362 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -94.43 -8.34 38.88 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.209 -0.932 . . . . 0.0 110.042 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 1.046 HG22 ' O ' ' B' ' 62' ' ' PHE . 33.6 m -136.7 132.79 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.362 -0.836 . . . . 0.0 109.676 179.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 103.05 11.19 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.346 -0.846 . . . . 0.0 109.793 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.679 ' CG2' HD12 ' B' ' 72' ' ' ILE . 18.2 mt -87.98 130.67 45.61 Favored Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.297 -0.877 . . . . 0.0 110.215 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.55 ' HD2' ' CG2' ' B' ' 68' ' ' ILE . 40.7 Cg_endo -40.56 163.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 O-C-N 123.889 1.468 . . . . 0.0 110.501 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -75.47 3.03 10.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.334 -0.854 . . . . 0.0 111.008 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.56 -24.83 29.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.052 -1.03 . . . . 0.0 109.902 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.679 HD12 ' CG2' ' B' ' 68' ' ' ILE . 84.4 mt -95.55 108.6 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 110.417 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 89.9 m -95.83 157.31 15.95 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.41 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 6' ' ' HIS . 3.2 p -143.29 137.37 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 111.539 -179.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.22 -179.4 3.94 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.343 0.592 . . . . 0.0 110.167 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 46.5 p -128.83 154.37 46.51 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 109.929 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.419 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -171.72 -170.16 35.39 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.419 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 57.7 m-85 -147.58 151.25 35.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.33 -1.1 . . . . 0.0 110.284 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -125.16 167.14 15.23 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 0.0 109.982 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 27.3 t -131.06 103.95 6.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.097 -1.002 . . . . 0.0 110.284 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.619 HG23 ' O ' ' B' ' 81' ' ' ILE . 6.7 tt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.232 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mtp . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.72 ' O ' HG23 ' A' ' 2' ' ' THR . 15.1 t -92.0 113.78 60.04 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.978 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.502 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -62.55 160.33 32.54 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.894 1.47 . . . . 0.0 110.281 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.436 HG21 ' SD ' ' A' ' 79' ' ' MET . 1.0 OUTLIER -143.29 122.37 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.372 -0.83 . . . . 0.0 109.939 179.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.72 HG13 ' CG2' ' A' ' 74' ' ' VAL . 85.5 t -94.28 130.08 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.2 -0.937 . . . . 0.0 110.616 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.546 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.83 122.22 45.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.245 -0.909 . . . . 0.0 109.729 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.533 ' HG ' ' CG2' ' A' ' 72' ' ' ILE . 0.7 OUTLIER -115.67 135.97 53.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 0.0 110.792 -179.35 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.492 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 4.3 ttpp -140.65 166.18 25.44 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.216 -0.928 . . . . 0.0 109.834 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.46 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 150.9 -156.14 26.52 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -64.97 130.66 44.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.344 -1.092 . . . . 0.0 110.666 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.54 -63.1 1.23 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.301 -0.874 . . . . 0.0 110.551 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -44.87 -47.29 11.14 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 0.0 110.58 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.449 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 97.0 m -57.77 -30.52 65.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.16 -0.963 . . . . 0.0 110.545 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.968 ' HA ' HD12 ' A' ' 17' ' ' LEU . 6.8 mt -70.59 -33.51 71.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.17 -0.956 . . . . 0.0 110.263 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.51 -44.14 93.22 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.237 -0.914 . . . . 0.0 110.753 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 21.5 t -69.82 -38.24 76.51 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.246 -0.909 . . . . 0.0 110.856 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.968 HD12 ' HA ' ' A' ' 14' ' ' LEU . 21.6 mt -58.81 -56.19 25.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.561 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -45.95 -28.22 1.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.0 110.29 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.461 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 61.0 t80 -64.82 -31.12 72.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.176 -0.953 . . . . 0.0 109.903 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -67.61 -21.77 65.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.317 -0.864 . . . . 0.0 110.07 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.493 ' CE2' HD21 ' A' ' 51' ' ' LEU . 10.2 m-30 -66.25 -36.43 82.99 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.026 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -63.52 -41.0 98.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.277 -0.889 . . . . 0.0 110.031 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.06 -2.09 25.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.188 -0.945 . . . . 0.0 109.847 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.487 ' HB3' HD12 ' A' ' 27' ' ' LEU . 84.8 m-70 -144.69 35.48 1.16 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.412 -0.805 . . . . 0.0 109.351 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.524 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.6 t -57.55 -9.41 1.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.576 -0.702 . . . . 0.0 111.054 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.4 p -95.51 4.9 52.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.986 -1.071 . . . . 0.0 110.411 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.507 ' HA ' HD23 ' A' ' 27' ' ' LEU . 8.8 mt -92.59 -48.78 6.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.161 -0.962 . . . . 0.0 110.171 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.524 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 10.2 p90 -100.67 165.78 11.22 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.974 . . . . 0.0 109.755 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 m -101.33 -30.32 11.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.93 -1.106 . . . . 0.0 110.887 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.3 111.38 2.13 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.048 -1.033 . . . . 0.0 110.899 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.47 HG12 HD23 ' A' ' 51' ' ' LEU . 31.9 m -90.58 140.63 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.27 -0.894 . . . . 0.0 110.02 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.6 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.0 OUTLIER -90.89 145.56 24.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 162.12 8.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.247 -0.908 . . . . 0.0 110.43 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.5 m -68.32 132.5 47.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.276 -0.89 . . . . 0.0 110.475 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.622 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 55.5 p-90 -146.81 -178.33 6.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 109.826 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.638 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 25.6 t60 -162.35 174.43 12.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.001 -1.062 . . . . 0.0 110.719 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.638 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 34.4 m95 -78.57 98.28 6.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.519 -0.738 . . . . 0.0 110.024 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.8 p . . . . . 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 110.225 -179.994 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.506 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.416 0.627 . . . . 0.0 110.415 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.502 HG13 ' C ' ' A' ' 47' ' ' ALA . 19.6 mt -143.95 167.81 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 110.032 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 50' ' ' THR . 0.3 OUTLIER -147.16 -179.75 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.055 -1.028 . . . . 0.0 110.294 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.447 HG23 ' HD2' ' A' ' 6' ' ' HIS . 87.5 m -146.55 156.66 43.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.88 . . . . 0.0 109.945 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.493 HD21 ' CE2' ' A' ' 21' ' ' PHE . 1.5 mt -134.77 125.19 26.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.071 -1.018 . . . . 0.0 110.061 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 134.58 40.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.29 -0.882 . . . . 0.0 110.456 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.502 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 47.1 m-85 -120.25 154.83 34.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.232 -0.917 . . . . 0.0 110.308 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -86.4 -10.06 55.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 110.572 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.72 150.53 17.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.135 -0.978 . . . . 0.0 110.404 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 24.7 mt-10 -64.08 -39.08 93.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.898 . . . . 0.0 109.992 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.471 ' CD1' ' NE2' ' A' ' 61' ' ' GLN . 61.8 t-105 -53.57 -52.13 60.72 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.301 -0.874 . . . . 0.0 109.881 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.441 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 13.8 tt0 -57.37 -35.45 69.98 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.383 -0.823 . . . . 0.0 110.483 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 21.5 ttp85 -59.63 -50.45 73.81 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.083 -1.011 . . . . 0.0 110.966 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -60.93 -33.09 72.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.177 -0.952 . . . . 0.0 110.796 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.471 ' NE2' ' CD1' ' A' ' 57' ' ' TRP . 52.5 mt-30 -65.62 -47.34 75.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.158 -0.964 . . . . 0.0 110.207 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.989 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.0 OUTLIER -55.69 -44.0 76.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 110.033 179.714 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.6 mt -59.22 -35.62 73.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.282 -0.886 . . . . 0.0 110.491 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.7 t -77.72 -18.9 56.07 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.147 -0.971 . . . . 0.0 110.449 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -94.63 -9.44 35.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.621 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.989 HG22 ' O ' ' A' ' 62' ' ' PHE . 27.5 m -141.91 92.92 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.042 -1.036 . . . . 0.0 110.545 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -76.18 113.16 13.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.17 -0.956 . . . . 0.0 109.933 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.862 HG22 ' HD2' ' A' ' 69' ' ' PRO . 0.0 OUTLIER -89.76 162.94 34.5 Favored Pre-proline 0 N--CA 1.498 1.939 0 O-C-N 121.096 -1.003 . . . . 0.0 109.765 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.862 ' HD2' HG22 ' A' ' 68' ' ' ILE . 46.7 Cg_endo -60.93 -178.9 0.25 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.893 1.47 . . . . 0.0 110.133 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -91.97 -6.15 51.79 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 110.44 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.0 m -84.58 -20.35 31.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.0 110.022 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.533 ' CG2' ' HG ' ' A' ' 7' ' ' LEU . 33.0 mt -94.38 107.18 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.276 -0.89 . . . . 0.0 110.204 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -95.44 157.38 15.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 111.055 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.72 ' CG2' HG13 ' A' ' 5' ' ' VAL . 8.8 p -142.2 130.66 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.938 0.875 . . . . 0.0 111.24 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.75 172.79 6.64 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.311 0.577 . . . . 0.0 110.474 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.9 p -111.54 144.33 40.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.393 -0.817 . . . . 0.0 109.975 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -154.61 176.22 32.45 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -147.72 146.75 29.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.316 -1.108 . . . . 0.0 110.139 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.436 ' SD ' HG21 ' A' ' 4' ' ' ILE . 25.2 mtt -120.22 176.97 5.19 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.097 -1.002 . . . . 0.0 110.324 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.9 t -139.67 107.33 5.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.315 -0.866 . . . . 0.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.309 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mtp . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.217 0.532 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . 0.716 ' O ' HG23 ' B' ' 2' ' ' THR . 15.2 t -92.21 113.82 60.35 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.23 -0.919 . . . . 0.0 109.94 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -62.4 160.15 32.72 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 123.999 1.526 . . . . 0.0 110.333 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.471 HG21 ' SD ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -143.31 122.02 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.251 -0.906 . . . . 0.0 109.896 179.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.732 HG13 ' CG2' ' B' ' 74' ' ' VAL . 85.0 t -94.13 130.02 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.676 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.537 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.0 OUTLIER -105.5 122.97 47.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.279 -0.888 . . . . 0.0 109.565 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.547 ' HG ' ' CG2' ' B' ' 72' ' ' ILE . 0.7 OUTLIER -116.28 135.65 53.7 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.174 -0.954 . . . . 0.0 110.777 -179.427 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.499 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 4.4 ttpp -140.66 165.42 27.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 109.959 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.442 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 151.58 -155.78 26.33 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -65.0 130.96 45.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -1.117 . . . . 0.0 110.644 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.507 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.75 -62.66 1.47 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.393 -0.817 . . . . 0.0 110.613 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -45.64 -46.61 14.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 0.0 110.673 -179.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.423 HG22 HD11 ' B' ' 17' ' ' LEU . 97.1 m -58.09 -30.6 66.37 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.226 -0.921 . . . . 0.0 110.493 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.952 ' HA ' HD12 ' B' ' 17' ' ' LEU . 6.8 mt -70.83 -32.93 70.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 110.259 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.34 -44.44 92.64 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.295 -0.878 . . . . 0.0 110.651 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.456 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 16.4 t -70.14 -38.11 75.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.28 -0.888 . . . . 0.0 111.151 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.952 HD12 ' HA ' ' B' ' 14' ' ' LEU . 21.6 mt -58.65 -55.66 32.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.067 -1.02 . . . . 0.0 110.334 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -45.96 -29.05 1.29 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.264 -0.897 . . . . 0.0 110.251 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.456 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 60.0 t80 -64.76 -29.5 70.48 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.968 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -68.95 -21.58 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.32 -0.863 . . . . 0.0 110.015 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.509 ' CE2' HD21 ' B' ' 51' ' ' LEU . 9.5 m-30 -66.41 -36.94 84.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.897 . . . . 0.0 110.051 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -63.38 -40.83 98.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -75.05 -1.78 24.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.189 -0.944 . . . . 0.0 109.659 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.46 ' HB3' HD12 ' B' ' 27' ' ' LEU . 84.0 m-70 -144.86 35.19 1.13 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.443 -0.786 . . . . 0.0 109.421 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.526 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.7 t -57.61 -8.7 0.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.437 -0.789 . . . . 0.0 111.045 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 66.7 p -95.78 4.54 52.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.011 -1.056 . . . . 0.0 110.392 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' B' ' 27' ' ' LEU . 8.7 mt -92.32 -49.81 5.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 0.0 110.053 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.526 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 10.4 p90 -99.45 165.71 11.52 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 8.7 m -101.46 -30.96 11.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.037 -1.04 . . . . 0.0 110.969 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.37 111.63 2.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.072 -1.018 . . . . 0.0 110.71 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.505 HG12 HD23 ' B' ' 51' ' ' LEU . 32.9 m -90.59 143.35 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 110.127 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.622 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -92.09 144.99 24.87 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.15 -0.969 . . . . 0.0 110.459 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 161.7 9.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.381 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 15.7 m -68.09 132.14 46.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.279 -0.888 . . . . 0.0 110.508 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.6 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 56.1 p-90 -146.76 -177.97 5.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.876 . . . . 0.0 109.774 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.637 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 25.0 t60 -162.38 174.48 12.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.951 -1.093 . . . . 0.0 110.548 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.637 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 39.3 m95 -78.37 100.06 6.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.402 -0.811 . . . . 0.0 109.763 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 24.5 p . . . . . 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.815 . . . . 0.0 110.314 -179.667 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.502 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.39 0.614 . . . . 0.0 110.399 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.502 HG13 ' C ' ' B' ' 47' ' ' ALA . 20.0 mt -143.96 168.21 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.398 -0.814 . . . . 0.0 110.102 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . 0.414 HG13 ' N ' ' B' ' 50' ' ' THR . 0.3 OUTLIER -147.46 -179.8 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.11 -0.993 . . . . 0.0 110.254 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.444 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 89.9 m -146.41 156.76 43.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.0 109.852 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.509 HD21 ' CE2' ' B' ' 21' ' ' PHE . 1.6 mt -134.62 125.33 26.96 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.983 -1.073 . . . . 0.0 110.123 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.87 134.31 41.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.283 -0.886 . . . . 0.0 110.482 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.501 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 47.3 m-85 -120.29 155.01 34.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.289 -0.882 . . . . 0.0 110.243 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -86.39 -10.67 53.87 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.235 -0.916 . . . . 0.0 110.521 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.07 150.25 18.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 0.0 110.567 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 25.9 mt-10 -63.62 -39.14 93.62 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.254 -0.904 . . . . 0.0 109.938 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . 0.476 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 62.2 t-105 -53.6 -52.18 60.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.226 -0.922 . . . . 0.0 109.851 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -57.3 -35.64 70.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.38 -0.825 . . . . 0.0 110.621 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 22.1 ttp85 -59.68 -50.02 75.49 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.088 -1.008 . . . . 0.0 110.956 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -60.97 -33.36 73.09 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.249 -0.907 . . . . 0.0 110.817 -179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.476 ' NE2' ' CD1' ' B' ' 57' ' ' TRP . 53.3 mt-30 -65.64 -47.32 75.98 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.085 -1.01 . . . . 0.0 110.368 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.984 ' O ' HG22 ' B' ' 66' ' ' VAL . 0.8 OUTLIER -55.67 -43.89 76.76 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 109.971 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 87.0 mt -59.28 -35.56 73.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.298 -0.877 . . . . 0.0 110.474 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.8 t -77.83 -18.65 56.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.24 -0.912 . . . . 0.0 110.315 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -94.65 -9.81 33.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.115 -0.99 . . . . 0.0 110.566 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.984 HG22 ' O ' ' B' ' 62' ' ' PHE . 27.6 m -141.89 93.28 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 120.962 -1.086 . . . . 0.0 110.565 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.531 ' O ' ' HG3' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -76.33 113.13 13.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.228 -0.92 . . . . 0.0 110.081 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.897 HG22 ' HD2' ' B' ' 69' ' ' PRO . 0.0 OUTLIER -89.56 162.63 35.92 Favored Pre-proline 0 N--CA 1.497 1.891 0 O-C-N 121.153 -0.967 . . . . 0.0 109.611 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.897 ' HD2' HG22 ' B' ' 68' ' ' ILE . 46.2 Cg_endo -60.64 -177.25 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.841 1.443 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -93.51 -5.56 48.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.17 -0.956 . . . . 0.0 110.368 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 88.0 m -84.59 -20.38 31.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.193 -0.942 . . . . 0.0 110.002 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.547 ' CG2' ' HG ' ' B' ' 7' ' ' LEU . 36.6 mt -94.67 107.46 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.333 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 88.9 m -95.33 157.28 15.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.394 -0.816 . . . . 0.0 110.881 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.732 ' CG2' HG13 ' B' ' 5' ' ' VAL . 8.2 p -141.96 130.51 22.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 CA-C-O 121.948 0.88 . . . . 0.0 111.188 -178.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.78 171.42 7.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.352 0.596 . . . . 0.0 110.554 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 33.4 p -110.29 145.37 37.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.322 -0.862 . . . . 0.0 109.848 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -156.12 176.48 33.55 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -147.87 147.62 29.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.241 -1.152 . . . . 0.0 110.179 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.471 ' SD ' HG21 ' B' ' 4' ' ' ILE . 24.4 mtt -120.91 177.81 4.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.298 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.9 t -140.51 107.15 5.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.917 . . . . 0.0 110.358 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.198 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.247 0.546 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.34 150.89 77.74 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 46.4 Cg_endo -100.99 145.78 0.31 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.886 1.466 . . . . 0.0 110.313 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.78 167.68 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 110.145 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.1 t -145.91 130.29 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.201 -0.937 . . . . 0.0 110.413 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.541 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.8 m170 -105.98 125.16 50.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 109.959 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 HD11 ' A' ' 51' ' ' LEU . 1.9 pp -121.92 146.77 46.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.084 -1.01 . . . . 0.0 110.478 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.611 ' O ' HD13 ' A' ' 72' ' ' ILE . 12.4 ttmm -139.35 161.96 36.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.22 -0.925 . . . . 0.0 110.483 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.45 -165.93 38.13 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -65.05 140.37 58.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -1.217 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.455 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.42 -49.81 53.76 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 110.498 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -64.54 -43.53 93.7 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.279 -0.888 . . . . 0.0 110.845 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.7 m -57.81 -24.84 59.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.127 -0.983 . . . . 0.0 110.433 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.495 HD22 HD11 ' A' ' 7' ' ' LEU . 46.6 mt -79.75 -30.94 40.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.885 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -59.49 -41.82 90.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.478 -0.764 . . . . 0.0 110.558 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.53 -37.13 76.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.301 -0.874 . . . . 0.0 110.603 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 14' ' ' LEU . 11.9 mt -59.07 -52.36 66.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.154 -0.967 . . . . 0.0 110.613 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -45.24 -31.39 1.5 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.679 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -64.82 -40.69 95.59 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.246 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -66.91 -35.92 81.08 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.1 m-30 -66.45 -35.38 80.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 110.32 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -63.43 -40.57 97.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -75.01 -37.85 61.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.0 110.318 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.632 ' O ' ' N ' ' A' ' 26' ' ' THR . 90.7 m-70 -95.44 33.75 1.55 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.163 -0.961 . . . . 0.0 110.443 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.579 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 32.0 p -59.36 53.36 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.489 -0.757 . . . . 0.0 111.275 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.632 ' N ' ' O ' ' A' ' 24' ' ' HIS . 14.8 p -144.42 34.63 1.18 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.936 -1.102 . . . . 0.0 109.853 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.7 HD23 ' HG3' ' A' ' 58' ' ' GLN . 10.4 mt -146.77 -21.69 0.42 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.194 -0.941 . . . . 0.0 111.382 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.62 ' CE2' ' CG2' ' A' ' 31' ' ' VAL . 39.8 p90 -115.42 166.64 11.66 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.442 -1.411 . . . . 0.0 109.56 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.85 -32.33 10.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.923 -1.111 . . . . 0.0 111.514 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.605 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.45 117.7 2.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.801 -1.187 . . . . 0.0 111.111 -179.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.62 ' CG2' ' CE2' ' A' ' 28' ' ' TYR . 5.1 t -89.84 102.16 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 110.025 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.595 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 5.0 p -69.39 147.05 51.54 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.482 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.35 161.1 9.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 110.226 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.558 ' HA ' HG22 ' A' ' 49' ' ' VAL . 3.0 t -68.28 140.79 55.99 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.383 -0.823 . . . . 0.0 110.753 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.605 ' CE3' ' HB2' ' B' ' 32' ' ' SER . 63.2 p-90 -146.95 -176.1 5.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.405 -0.809 . . . . 0.0 109.418 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.5 p-80 -162.57 174.32 12.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.89 -1.131 . . . . 0.0 111.047 -179.775 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.507 ' CE3' ' HB1' ' B' ' 30' ' ' ALA . 57.7 m95 -79.13 118.46 21.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.538 -0.726 . . . . 0.0 110.09 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.0 m . . . . . 0 N--CA 1.492 1.637 0 O-C-N 121.334 -0.854 . . . . 0.0 110.306 -179.796 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 121.293 0.568 . . . . 0.0 110.418 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' TRP . 16.8 mt -142.74 141.85 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.297 -0.877 . . . . 0.0 109.958 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.558 HG22 ' HA ' ' A' ' 34' ' ' THR . 91.7 t -124.37 122.75 64.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.083 -1.011 . . . . 0.0 110.427 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.5 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 20.7 m -94.37 157.32 16.08 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.289 -0.882 . . . . 0.0 110.116 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.522 HD11 HD23 ' A' ' 7' ' ' LEU . 1.2 mt -135.32 130.98 35.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.254 -0.904 . . . . 0.0 110.198 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.605 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 63.4 p -96.76 127.29 42.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.237 -0.914 . . . . 0.0 110.464 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.556 ' OH ' ' CE2' ' A' ' 62' ' ' PHE . 27.4 m-85 -103.78 146.39 28.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 110.026 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 -9.68 55.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.175 -0.953 . . . . 0.0 110.769 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.9 p -162.62 134.98 5.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.068 -1.02 . . . . 0.0 110.591 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.409 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -51.93 -40.16 60.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.292 -0.88 . . . . 0.0 109.848 179.64 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 4.7 t-105 -53.55 -55.27 27.04 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.441 -0.787 . . . . 0.0 109.995 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.7 ' HG3' HD23 ' A' ' 27' ' ' LEU . 16.3 tt0 -57.03 -35.37 69.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.332 -0.855 . . . . 0.0 110.39 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.479 ' O ' ' HB3' ' A' ' 62' ' ' PHE . 7.3 ttp85 -59.52 -33.48 71.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.096 -1.003 . . . . 0.0 109.992 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -61.53 -60.8 3.14 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.359 -0.838 . . . . 0.0 111.305 -179.501 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.524 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 4.1 pm0 -65.14 -18.85 65.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.006 -1.059 . . . . 0.0 110.758 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.599 ' O ' HG22 ' A' ' 66' ' ' VAL . 38.4 t80 -57.25 -65.01 0.7 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.009 -1.057 . . . . 0.0 110.401 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.577 ' HA ' HG22 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -59.51 -39.86 85.2 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.478 -0.764 . . . . 0.0 111.312 -179.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.51 -22.03 66.68 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.907 -1.121 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.524 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 15.6 mm-40 -95.37 -30.54 13.86 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.344 -0.848 . . . . 0.0 109.967 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.799 ' O ' HG23 ' A' ' 66' ' ' VAL . 15.1 m -97.91 85.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.302 -0.874 . . . . 0.0 109.72 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.47 ' C ' ' O ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -38.44 105.77 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.342 -0.849 . . . . 0.0 110.441 -179.639 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.507 ' O ' HG23 ' A' ' 68' ' ' ILE . 10.9 tt -89.53 126.67 57.4 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.532 -0.73 . . . . 0.0 110.17 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.08 -177.81 1.48 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.926 1.487 . . . . 0.0 110.396 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -86.64 -12.79 47.47 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.216 -0.928 . . . . 0.0 110.226 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.74 -11.21 56.28 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 110.165 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.611 HD13 ' O ' ' A' ' 8' ' ' LYS . 9.8 mm -94.37 121.33 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.16 -0.962 . . . . 0.0 109.96 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.3 m -95.23 136.09 36.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.05 -1.031 . . . . 0.0 109.818 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.2 t -88.75 156.97 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.055 -1.028 . . . . 0.0 110.871 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.541 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 1.2 m -142.73 154.83 44.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.833 -0.542 . . . . 0.0 110.341 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.1 p -133.0 134.98 45.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.075 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.6 -175.57 30.71 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -148.1 152.78 37.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.206 -1.173 . . . . 0.0 110.528 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -123.74 169.69 11.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.334 -0.854 . . . . 0.0 109.949 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.713 ' C ' HD12 ' A' ' 81' ' ' ILE . 9.6 t -150.22 99.65 2.82 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.244 -0.91 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.713 HD12 ' C ' ' A' ' 80' ' ' SER . 1.1 mp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.051 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.306 0.574 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.2 150.45 76.54 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.25 -0.906 . . . . 0.0 110.094 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.507 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.2 Cg_endo -100.19 145.59 0.38 Allowed 'Trans proline' 0 C--N 1.304 -1.791 0 O-C-N 123.94 1.494 . . . . 0.0 110.187 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.72 168.09 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.02 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -146.12 130.35 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.93 . . . . 0.0 110.426 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.569 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.7 m170 -106.09 125.64 51.23 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.297 -0.877 . . . . 0.0 109.782 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.517 HD23 HD11 ' B' ' 51' ' ' LEU . 1.9 pp -122.76 147.26 46.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.987 -1.071 . . . . 0.0 110.536 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.625 ' O ' HD13 ' B' ' 72' ' ' ILE . 12.4 ttmm -139.61 162.03 36.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.288 -0.882 . . . . 0.0 110.465 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.84 -166.38 38.57 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -64.93 140.18 58.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -1.172 . . . . 0.0 110.252 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.453 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.97 -49.56 49.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -65.0 -43.52 92.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.828 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 75.5 m -57.64 -24.28 55.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.184 -0.948 . . . . 0.0 110.504 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.479 HD22 HD11 ' B' ' 7' ' ' LEU . 41.7 mt -80.82 -30.64 35.78 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.155 -0.966 . . . . 0.0 109.918 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -59.42 -41.91 90.6 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.406 -0.808 . . . . 0.0 110.45 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -69.78 -37.27 76.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.369 -0.832 . . . . 0.0 110.605 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 mt -58.82 -51.55 69.54 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.033 -1.042 . . . . 0.0 110.297 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.5 ttp85 -45.49 -31.69 1.88 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.291 -0.88 . . . . 0.0 110.582 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -64.78 -40.6 95.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.109 -0.994 . . . . 0.0 110.239 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -67.15 -35.76 80.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.145 -0.972 . . . . 0.0 110.156 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.427 ' N ' ' CD1' ' B' ' 21' ' ' PHE . 10.1 m-30 -66.43 -35.11 79.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -63.51 -40.87 98.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.313 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -75.02 -38.03 61.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.165 -0.96 . . . . 0.0 110.452 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.633 ' O ' ' N ' ' B' ' 26' ' ' THR . 91.3 m-70 -95.25 33.8 1.51 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.202 -0.936 . . . . 0.0 110.348 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.594 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 32.0 p -59.34 53.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.536 -0.727 . . . . 0.0 111.318 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.633 ' N ' ' O ' ' B' ' 24' ' ' HIS . 9.3 p -144.38 34.73 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.908 -1.12 . . . . 0.0 109.822 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.678 HD23 ' HG3' ' B' ' 58' ' ' GLN . 10.9 mt -146.9 -21.47 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.181 -0.949 . . . . 0.0 111.356 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.594 ' CE1' ' HA ' ' B' ' 25' ' ' CYS . 39.5 p90 -115.45 166.73 11.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.604 -1.31 . . . . 0.0 109.558 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -32.6 10.57 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.941 -1.099 . . . . 0.0 111.583 -179.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.598 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.58 118.07 2.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.816 -1.177 . . . . 0.0 111.08 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.593 ' CG2' ' CE2' ' B' ' 28' ' ' TYR . 4.6 t -89.91 101.08 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.361 -0.837 . . . . 0.0 110.086 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.605 ' HB2' ' CE3' ' A' ' 35' ' ' TRP . 5.5 p -67.85 146.78 53.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.075 -1.016 . . . . 0.0 110.438 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.38 161.6 9.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.221 -0.925 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.564 ' HA ' HG22 ' B' ' 49' ' ' VAL . 3.5 t -68.27 140.38 55.99 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.3 -0.875 . . . . 0.0 110.628 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.595 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 62.8 p-90 -147.03 -176.43 5.21 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.369 -0.832 . . . . 0.0 109.542 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 2.6 p-80 -162.44 174.4 12.77 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.839 -1.163 . . . . 0.0 111.121 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.465 ' CE3' ' HB1' ' A' ' 30' ' ' ALA . 56.8 m95 -79.21 118.34 21.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.447 -0.783 . . . . 0.0 110.183 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 20.4 m . . . . . 0 N--CA 1.492 1.635 0 O-C-N 121.322 -0.861 . . . . 0.0 110.248 -179.928 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.68 0 CA-C-O 121.307 0.575 . . . . 0.0 110.504 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 35' ' ' TRP . 15.9 mt -142.61 142.05 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.415 -0.803 . . . . 0.0 109.996 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . 0.564 HG22 ' HA ' ' B' ' 34' ' ' THR . 88.9 t -124.47 121.91 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.069 -1.019 . . . . 0.0 110.209 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.569 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 18.1 m -93.8 157.7 16.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.933 . . . . 0.0 109.953 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.517 HD11 HD23 ' B' ' 7' ' ' LEU . 1.2 mt -135.26 131.53 36.7 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.114 -0.991 . . . . 0.0 110.266 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.598 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 56.6 p -97.06 127.52 43.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.372 -0.83 . . . . 0.0 110.51 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.52 ' OH ' ' CE2' ' B' ' 62' ' ' PHE . 28.7 m-85 -104.32 146.43 28.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.892 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.63 -8.65 57.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 110.805 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 73.1 p -163.83 135.21 4.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.067 -1.02 . . . . 0.0 110.585 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.95 -40.27 60.59 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.86 . . . . 0.0 109.961 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -53.42 -54.99 28.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.333 -0.854 . . . . 0.0 109.894 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.678 ' HG3' HD23 ' B' ' 27' ' ' LEU . 17.4 tt0 -57.02 -36.0 69.93 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.386 -0.821 . . . . 0.0 110.455 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' B' ' 62' ' ' PHE . 6.4 ttp180 -59.54 -33.17 71.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.971 -1.081 . . . . 0.0 110.128 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' B' ' 63' ' ' LEU . 0.3 OUTLIER -61.48 -60.81 3.14 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.394 -0.816 . . . . 0.0 111.205 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.526 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 4.2 pm0 -65.17 -19.14 65.83 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.902 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.612 ' O ' HG22 ' B' ' 66' ' ' VAL . 36.2 t80 -57.02 -65.35 0.63 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.055 -1.028 . . . . 0.0 110.36 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.58 ' HA ' HG22 ' B' ' 66' ' ' VAL . 0.4 OUTLIER -59.36 -39.37 83.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.452 -0.78 . . . . 0.0 111.305 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.87 -21.82 66.49 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.859 -1.151 . . . . 0.0 110.292 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 15.4 mm-40 -95.42 -30.95 13.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.896 . . . . 0.0 109.985 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.797 HG23 ' O ' ' B' ' 66' ' ' VAL . 16.6 m -97.42 85.49 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 109.895 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.466 ' C ' ' O ' ' B' ' 66' ' ' VAL . 0.1 OUTLIER -37.84 105.92 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.421 -0.8 . . . . 0.0 110.56 -179.711 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.503 ' O ' HG23 ' B' ' 68' ' ' ILE . 10.3 tt -89.89 126.7 56.62 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.359 -0.838 . . . . 0.0 110.182 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -67.93 -177.88 1.46 Allowed 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 124.018 1.536 . . . . 0.0 110.32 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -86.74 -12.85 47.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.248 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -11.58 55.42 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 110.216 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.625 HD13 ' O ' ' B' ' 8' ' ' LYS . 9.8 mm -94.3 121.41 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.217 -0.927 . . . . 0.0 109.898 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.0 m -95.41 136.35 35.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.018 -1.052 . . . . 0.0 109.937 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 11.1 t -88.55 156.92 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.029 -1.045 . . . . 0.0 111.074 -178.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . 0.543 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 1.4 m -142.52 154.76 44.77 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.75 -0.594 . . . . 0.0 110.402 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.0 p -133.1 134.68 44.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.175 -0.953 . . . . 0.0 110.103 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.51 -175.62 30.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -147.88 153.01 38.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.177 -1.19 . . . . 0.0 110.509 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -124.12 168.6 12.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.272 -0.892 . . . . 0.0 110.039 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.721 ' C ' HD12 ' B' ' 81' ' ' ILE . 9.2 t -149.08 99.87 3.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.145 -0.972 . . . . 0.0 110.417 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.721 HD12 ' C ' ' B' ' 80' ' ' SER . 1.1 mp . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 118.035 -0.984 . . . . 0.0 109.969 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.455 ' HB3' ' CD2' ' A' ' 78' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.246 0.546 . . . . 0.0 110.152 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -146.39 170.89 7.13 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.212 -0.93 . . . . 0.0 110.303 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 51.9 Cg_endo -104.61 145.6 0.13 Allowed 'Trans proline' 0 C--N 1.307 -1.638 0 O-C-N 124.034 1.544 . . . . 0.0 110.308 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.511 HD11 ' SD ' ' B' ' 79' ' ' MET . 2.8 pt -143.82 162.63 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.212 -0.93 . . . . 0.0 110.041 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.534 HG23 HG22 ' A' ' 74' ' ' VAL . 9.6 p -145.78 127.47 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 0.0 110.074 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.613 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.1 m170 -104.13 118.32 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.348 -0.845 . . . . 0.0 110.135 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.626 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.3 pp -111.54 150.91 29.31 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.127 -0.983 . . . . 0.0 110.222 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.517 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 7.6 tptm -138.71 159.27 42.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 110.482 -179.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.517 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 170.67 -174.56 44.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.482 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 40.2 m-20 -65.05 141.49 58.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.153 -1.204 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.33 -69.28 0.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.238 -0.914 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -47.78 -44.96 28.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.065 -1.022 . . . . 0.0 110.385 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.482 ' HB ' ' HB2' ' A' ' 10' ' ' ASP . 41.4 m -58.22 -22.81 53.55 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.257 -0.902 . . . . 0.0 110.61 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 62.8 mt -78.39 -29.79 47.46 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.179 -0.951 . . . . 0.0 110.532 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -59.71 -34.44 72.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.211 -0.931 . . . . 0.0 110.417 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.504 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.9 t -70.27 -46.13 64.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.358 -0.839 . . . . 0.0 110.943 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.8 mp -58.82 -52.76 64.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.057 -1.027 . . . . 0.0 110.59 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.413 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 10.5 ttm180 -45.04 -24.69 0.25 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.221 -0.924 . . . . 0.0 110.516 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.504 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 40.1 t80 -64.8 -40.46 95.26 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.078 -1.014 . . . . 0.0 110.234 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -72.88 -21.18 60.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 110.134 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 8.6 m-30 -66.26 -31.32 72.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 109.954 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -63.57 -33.98 76.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.338 -0.851 . . . . 0.0 110.336 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -75.08 -35.15 61.82 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.245 -0.909 . . . . 0.0 110.41 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.643 ' HB3' HD12 ' A' ' 27' ' ' LEU . 73.4 m-70 -94.48 40.93 1.09 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.243 -0.91 . . . . 0.0 110.12 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.581 ' SG ' HG23 ' A' ' 26' ' ' THR . 27.3 p -57.65 -21.52 40.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.355 -0.841 . . . . 0.0 110.512 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.581 HG23 ' SG ' ' A' ' 25' ' ' CYS . 69.2 p -96.52 10.91 36.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.095 -1.003 . . . . 0.0 110.499 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.643 HD12 ' HB3' ' A' ' 24' ' ' HIS . 2.3 mt -92.26 -49.39 6.2 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 110.16 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.467 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 4.4 p90 -98.9 168.56 10.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.247 -0.908 . . . . 0.0 110.236 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.1 m -98.92 -31.35 11.87 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.848 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.08 116.09 2.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.011 -1.056 . . . . 0.0 110.608 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.409 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.2 p -90.2 135.06 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.883 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.486 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -108.37 154.25 22.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.083 -1.011 . . . . 0.0 110.689 -179.689 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.35 162.56 7.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.359 -0.838 . . . . 0.0 110.265 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.2 t -68.14 131.06 44.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.26 -0.9 . . . . 0.0 110.751 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.556 ' HB3' ' CB ' ' B' ' 35' ' ' TRP . 3.9 p-90 -146.93 157.51 43.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.353 -0.842 . . . . 0.0 109.405 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 5.3 p80 -162.58 -173.73 3.67 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.823 -1.173 . . . . 0.0 111.354 -179.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.6 m95 -79.97 138.82 37.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.66 -0.65 . . . . 0.0 110.114 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 110.408 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.413 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 121.322 0.582 . . . . 0.0 109.968 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.626 HG23 ' O ' ' A' ' 7' ' ' LEU . 74.1 mt -145.03 133.76 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.326 -0.859 . . . . 0.0 110.123 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.423 ' O ' ' CD2' ' A' ' 7' ' ' LEU . 19.1 t -119.73 130.27 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.049 -1.032 . . . . 0.0 110.442 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.58 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 3.0 m -94.16 156.41 16.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.336 -0.853 . . . . 0.0 110.234 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.498 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 1.0 OUTLIER -135.01 129.98 34.97 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.245 -0.909 . . . . 0.0 109.637 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.11 130.94 44.32 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.217 -0.927 . . . . 0.0 110.675 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HG2' ' A' ' 3' ' ' PRO . 49.0 m-85 -118.48 155.79 30.21 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.383 -0.823 . . . . 0.0 109.956 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.69 -10.32 59.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 110.32 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.9 p -170.26 166.19 8.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.168 -0.958 . . . . 0.0 110.305 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.44 -34.96 73.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.344 -0.848 . . . . 0.0 110.171 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -53.79 -50.82 65.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.342 -0.848 . . . . 0.0 110.12 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -57.95 -38.04 75.25 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.251 -0.906 . . . . 0.0 110.855 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.582 ' HE ' HD11 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -59.18 -44.31 92.17 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.003 -1.06 . . . . 0.0 110.745 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.441 ' HA ' HD12 ' A' ' 63' ' ' LEU . 46.7 t0 -61.01 -38.58 86.6 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.104 -0.998 . . . . 0.0 110.518 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -65.92 -41.49 91.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.134 -0.979 . . . . 0.0 110.725 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.897 ' O ' HG22 ' A' ' 66' ' ' VAL . 2.7 t80 -55.85 -47.4 77.35 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.582 HD11 ' HE ' ' A' ' 59' ' ' ARG . 13.5 mt -59.44 -44.66 92.9 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.256 -0.903 . . . . 0.0 110.459 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -21.45 66.54 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.254 -0.904 . . . . 0.0 110.63 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -95.44 -25.26 16.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.085 -1.01 . . . . 0.0 110.369 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.897 HG22 ' O ' ' A' ' 62' ' ' PHE . 31.2 m -103.64 105.06 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.892 . . . . 0.0 110.036 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -51.4 97.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.192 -0.943 . . . . 0.0 110.395 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.618 ' O ' HG23 ' A' ' 68' ' ' ILE . 9.4 tp -88.66 117.5 68.39 Favored Pre-proline 0 N--CA 1.487 1.424 0 O-C-N 121.169 -0.957 . . . . 0.0 109.979 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.689 ' CG ' HD12 ' A' ' 72' ' ' ILE . 46.2 Cg_endo -60.58 167.97 7.45 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.916 1.482 . . . . 0.0 110.852 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -79.53 -12.98 59.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.45 -0.782 . . . . 0.0 110.315 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.61 -23.73 29.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.27 -0.894 . . . . 0.0 110.227 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.689 HD12 ' CG ' ' A' ' 69' ' ' PRO . 66.0 mt -93.68 115.27 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.913 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.3 m -95.09 142.48 27.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.323 -0.861 . . . . 0.0 110.727 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.616 HG22 ' H ' ' A' ' 75' ' ' SER . 6.0 p -92.25 178.49 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.421 -0.799 . . . . 0.0 110.582 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.616 ' H ' HG22 ' A' ' 74' ' ' VAL . 0.6 OUTLIER -143.85 158.76 43.47 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.499 179.216 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.6 p -133.86 135.12 43.5 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.231 -0.918 . . . . 0.0 110.058 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -160.74 177.03 37.31 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.455 ' CD2' ' HB3' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.93 120.43 8.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.287 -1.125 . . . . 0.0 109.969 -179.802 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.518 ' SD ' HD11 ' B' ' 4' ' ' ILE . 18.3 mmm -95.13 171.74 8.55 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.051 -1.031 . . . . 0.0 110.576 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.422 ' O ' HG23 ' A' ' 81' ' ' ILE . 86.3 p -153.67 107.81 3.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.33 -0.856 . . . . 0.0 110.305 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.422 HG23 ' O ' ' A' ' 80' ' ' SER . 4.6 pt . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.225 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.487 ' CG ' ' O ' ' B' ' 79' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.198 0.523 . . . . 0.0 110.11 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.5 t -146.13 171.96 5.84 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.262 -0.899 . . . . 0.0 110.103 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.499 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 51.1 Cg_endo -106.13 145.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.847 1.446 . . . . 0.0 110.054 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.518 HD11 ' SD ' ' A' ' 79' ' ' MET . 2.7 pt -143.83 162.79 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.253 -0.904 . . . . 0.0 110.04 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.562 HG23 HG22 ' B' ' 74' ' ' VAL . 8.6 p -145.67 127.84 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.336 -0.853 . . . . 0.0 110.08 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.614 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 1.5 m170 -104.66 118.19 35.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.355 -0.841 . . . . 0.0 110.148 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.649 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.3 pp -111.35 150.93 29.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 110.219 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.522 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 7.7 tptm -138.56 159.53 41.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 110.381 -179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.522 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 170.23 -174.55 44.3 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . 0.485 ' HB2' ' HB ' ' B' ' 13' ' ' THR . 40.6 m-20 -65.12 141.83 58.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.126 -1.22 . . . . 0.0 110.291 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.37 -69.4 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.315 -0.865 . . . . 0.0 110.524 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -47.54 -45.49 26.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.156 -0.965 . . . . 0.0 110.528 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.485 ' HB ' ' HB2' ' B' ' 10' ' ' ASP . 37.2 m -58.14 -22.09 49.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 110.723 -179.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 65.2 mt -78.83 -29.69 44.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.141 -0.975 . . . . 0.0 110.487 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -59.82 -34.4 73.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.213 -0.929 . . . . 0.0 110.319 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.506 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 1.6 t -70.31 -46.49 64.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.215 -0.928 . . . . 0.0 110.966 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.64 -52.81 64.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.066 -1.021 . . . . 0.0 110.536 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -45.09 -24.74 0.26 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 110.621 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 41.5 t80 -64.8 -39.7 94.02 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.216 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -73.41 -21.29 60.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.145 -0.972 . . . . 0.0 110.159 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -66.18 -31.43 72.26 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.228 -0.92 . . . . 0.0 109.897 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -63.49 -33.76 76.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.12 -35.16 61.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.175 -0.953 . . . . 0.0 110.436 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.643 ' HB3' HD12 ' B' ' 27' ' ' LEU . 76.0 m-70 -94.84 41.16 1.09 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.942 . . . . 0.0 110.169 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.605 ' SG ' HG23 ' B' ' 26' ' ' THR . 27.5 p -57.32 -21.07 32.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.359 -0.838 . . . . 0.0 110.379 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.605 HG23 ' SG ' ' B' ' 25' ' ' CYS . 69.8 p -96.91 10.63 38.51 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.128 -0.982 . . . . 0.0 110.467 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.643 HD12 ' HB3' ' B' ' 24' ' ' HIS . 2.6 mt -92.23 -49.18 6.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.19 -0.944 . . . . 0.0 110.286 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.478 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 4.3 p90 -98.92 168.45 10.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.5 m -98.78 -31.12 12.04 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.25 -0.906 . . . . 0.0 110.68 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.29 116.44 2.7 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.011 -1.056 . . . . 0.0 110.594 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.411 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.2 p -90.27 135.14 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.304 -0.873 . . . . 0.0 109.663 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.478 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -108.2 154.66 21.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.114 -0.991 . . . . 0.0 110.615 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.39 162.44 7.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.43 -0.794 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 2.1 t -68.24 130.51 43.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.266 -0.896 . . . . 0.0 110.64 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.556 ' CB ' ' HB3' ' A' ' 35' ' ' TRP . 4.3 p-90 -146.83 157.33 43.63 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.287 -0.883 . . . . 0.0 109.368 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 6.2 p80 -162.45 -173.68 3.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.866 -1.146 . . . . 0.0 111.359 -179.533 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -79.89 139.94 36.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.686 -0.634 . . . . 0.0 109.995 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.625 0 O-C-N 121.199 -0.938 . . . . 0.0 110.322 -179.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.334 0.588 . . . . 0.0 110.176 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.649 HG23 ' O ' ' B' ' 7' ' ' LEU . 74.7 mt -144.98 133.32 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 109.967 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . 0.422 ' O ' ' CD2' ' B' ' 7' ' ' LEU . 16.5 t -119.2 130.37 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.038 -1.039 . . . . 0.0 110.424 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.587 HG23 ' CD2' ' B' ' 6' ' ' HIS . 2.7 m -94.07 157.1 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.308 -0.87 . . . . 0.0 110.27 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.495 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 1.0 OUTLIER -135.51 129.84 33.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 179.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.13 131.01 44.31 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.154 -0.966 . . . . 0.0 110.711 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 44.0 m-85 -118.65 155.44 31.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 0.0 110.085 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -70.8 -10.1 58.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.156 -0.965 . . . . 0.0 110.488 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 40.7 p -170.1 166.17 9.13 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.209 -0.932 . . . . 0.0 110.269 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -70.59 -35.1 72.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.182 -0.948 . . . . 0.0 110.236 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.47 -51.04 64.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.403 -0.811 . . . . 0.0 110.224 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -58.02 -37.18 73.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 110.734 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.58 ' HE ' HD11 ' B' ' 63' ' ' LEU . 0.2 OUTLIER -59.55 -44.71 93.18 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.085 -1.01 . . . . 0.0 110.631 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.432 ' HA ' HD12 ' B' ' 63' ' ' LEU . 48.0 t0 -60.94 -38.41 85.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.197 -0.94 . . . . 0.0 110.624 -179.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -65.8 -41.44 91.93 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.268 -0.895 . . . . 0.0 110.747 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.912 ' O ' HG22 ' B' ' 66' ' ' VAL . 2.3 t80 -55.96 -47.41 77.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.156 -0.965 . . . . 0.0 110.24 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.58 HD11 ' HE ' ' B' ' 59' ' ' ARG . 13.7 mt -59.48 -43.95 93.14 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.166 -0.959 . . . . 0.0 110.652 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -21.33 66.23 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.204 -0.935 . . . . 0.0 110.628 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.31 -25.27 16.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.157 -0.964 . . . . 0.0 110.296 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.912 HG22 ' O ' ' B' ' 62' ' ' PHE . 32.4 m -103.78 104.81 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.3 -0.875 . . . . 0.0 109.952 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttt -51.34 97.59 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.319 -0.863 . . . . 0.0 110.379 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.595 ' O ' HG23 ' B' ' 68' ' ' ILE . 8.6 tp -88.43 117.77 68.73 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.259 -0.9 . . . . 0.0 109.932 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.713 ' CG ' HD12 ' B' ' 72' ' ' ILE . 48.7 Cg_endo -61.23 168.25 8.03 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.889 1.468 . . . . 0.0 110.594 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -79.98 -12.81 59.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.283 -0.886 . . . . 0.0 110.347 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.53 -23.08 29.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.224 -0.923 . . . . 0.0 110.09 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.713 HD12 ' CG ' ' B' ' 69' ' ' PRO . 67.5 mt -94.21 115.29 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.253 -0.905 . . . . 0.0 110.026 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 7.7 m -95.23 142.38 27.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.33 -0.856 . . . . 0.0 110.839 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.608 HG22 ' H ' ' B' ' 75' ' ' SER . 5.4 p -92.28 178.65 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.278 -0.889 . . . . 0.0 110.52 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . 0.614 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -144.03 158.64 43.58 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.397 -0.814 . . . . 0.0 110.622 179.125 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.9 p -133.57 134.72 43.67 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 110.129 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.94 176.83 36.62 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.427 ' CD2' ' HB3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -148.06 119.94 8.16 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.316 -1.108 . . . . 0.0 109.82 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.511 ' SD ' HD11 ' A' ' 4' ' ' ILE . 19.1 mmm -94.52 173.08 7.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.971 -1.081 . . . . 0.0 110.472 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.421 ' O ' HG23 ' B' ' 81' ' ' ILE . 85.9 p -154.85 107.16 2.73 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.222 -0.924 . . . . 0.0 110.272 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.421 HG23 ' O ' ' B' ' 80' ' ' SER . 4.8 pt . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 117.921 -1.038 . . . . 0.0 110.262 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.205 0.526 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.5 m -68.61 121.65 81.77 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 121.263 -0.898 . . . . 0.0 110.122 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.512 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 47.1 Cg_endo -69.11 157.17 62.68 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.08 1.568 . . . . 0.0 110.52 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.605 HD11 ' HG2' ' B' ' 79' ' ' MET . 5.1 pt -143.02 169.13 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.231 -0.918 . . . . 0.0 110.031 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.575 ' CG1' HG21 ' A' ' 74' ' ' VAL . 6.4 t -145.8 125.64 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.211 -0.931 . . . . 0.0 110.187 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.47 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -106.19 119.02 38.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.347 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.738 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.4 mp -116.5 147.4 41.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.312 -0.867 . . . . 0.0 110.177 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 1.074 ' O ' HD12 ' A' ' 72' ' ' ILE . 11.5 tttt -142.42 168.5 19.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.214 -0.929 . . . . 0.0 110.388 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.432 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 151.76 -166.02 30.73 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 131.01 45.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.194 -1.18 . . . . 0.0 110.253 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.97 -39.8 41.98 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.28 -0.887 . . . . 0.0 110.726 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -66.08 -46.91 76.02 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.077 -1.015 . . . . 0.0 110.605 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 5.8 m -58.1 -27.77 64.0 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.938 . . . . 0.0 110.367 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.702 HD21 HD13 ' A' ' 72' ' ' ILE . 77.7 mt -77.71 -27.4 50.65 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.969 . . . . 0.0 110.34 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.2 ttmt -59.35 -39.39 83.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.252 -0.905 . . . . 0.0 110.411 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.2 t -70.19 -34.23 72.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.098 -1.001 . . . . 0.0 110.423 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 13' ' ' THR . 5.9 mp -58.94 -51.91 68.01 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.212 -0.93 . . . . 0.0 110.558 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.509 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 1.2 ttp-105 -46.22 -31.86 2.7 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.264 -0.897 . . . . 0.0 110.124 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.49 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 48.4 t80 -65.14 -33.06 75.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.306 -0.871 . . . . 0.0 110.391 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 -74.74 -30.32 61.46 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.203 -0.936 . . . . 0.0 110.465 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.509 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 11.1 m-30 -66.32 -21.58 66.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 29.4 mmtp -63.38 -36.53 84.02 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.615 -179.851 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -75.1 -40.95 59.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -0.936 . . . . 0.0 110.463 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.626 ' HB3' HD12 ' A' ' 27' ' ' LEU . 15.0 m-70 -95.12 36.52 1.21 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.227 -0.921 . . . . 0.0 110.328 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.607 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 32.0 p -57.44 -17.92 15.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.474 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.95 -3.29 41.99 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.206 -0.934 . . . . 0.0 110.518 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.626 HD12 ' HB3' ' A' ' 24' ' ' HIS . 11.2 mt -92.42 -6.19 50.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.181 -0.949 . . . . 0.0 110.495 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.607 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 22.7 p90 -144.58 -178.08 5.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.194 -0.941 . . . . 0.0 109.528 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 45.6 m -96.47 -68.99 0.77 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.914 -1.116 . . . . 0.0 110.584 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.2 20.79 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.081 -1.012 . . . . 0.0 109.012 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 31' ' ' VAL . 12.7 p -91.29 112.58 25.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 O-C-N 121.681 -0.637 . . . . 0.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.442 ' OG ' ' HB ' ' A' ' 50' ' ' THR . 79.5 p -52.59 152.62 3.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.926 -1.109 . . . . 0.0 109.373 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.417 ' OG ' ' HB2' ' B' ' 35' ' ' TRP . 0.8 OUTLIER -60.93 155.08 20.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.166 -0.959 . . . . 0.0 110.305 -179.651 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -67.64 129.78 40.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.333 -0.855 . . . . 0.0 110.318 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.483 ' HB2' ' OG ' ' B' ' 33' ' ' SER . 44.4 p-90 -146.15 176.15 9.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.189 -0.944 . . . . 0.0 109.921 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.486 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . 53.2 t-80 -162.57 177.83 9.09 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 110.351 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.471 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 80.2 m95 -78.51 123.99 27.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.225 -0.922 . . . . 0.0 110.126 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 m . . . . . 0 N--CA 1.49 1.567 0 O-C-N 121.37 -0.831 . . . . 0.0 109.916 -179.799 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.487 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.559 0 CA-C-O 121.233 0.539 . . . . 0.0 110.068 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.738 HG23 ' O ' ' A' ' 7' ' ' LEU . 70.3 mt -142.07 144.56 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 110.353 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.535 HG12 ' N ' ' A' ' 50' ' ' THR . 67.5 t -116.79 169.07 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.285 -0.884 . . . . 0.0 110.458 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.535 ' N ' HG12 ' A' ' 49' ' ' VAL . 17.4 m -146.05 152.16 38.89 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.369 -0.832 . . . . 0.0 109.891 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.42 128.78 32.17 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.169 -0.957 . . . . 0.0 110.249 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.47 ' OG1' ' CZ3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.61 40.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.361 -0.837 . . . . 0.0 110.158 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.541 ' CD2' ' HA ' ' A' ' 59' ' ' ARG . 40.2 m-85 -111.91 147.35 36.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.203 -0.936 . . . . 0.0 109.93 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -93.21 -3.28 54.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 110.941 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.1 p -157.66 121.04 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.028 -1.045 . . . . 0.0 110.328 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.485 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 2.3 mt-10 -46.32 -42.44 14.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.867 . . . . 0.0 110.132 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.413 ' CD1' ' NE2' ' A' ' 61' ' ' GLN . 16.0 t-105 -53.66 -56.0 21.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -59.07 -31.21 68.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.291 -0.881 . . . . 0.0 110.629 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.541 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -59.34 -54.55 45.43 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.273 -0.892 . . . . 0.0 111.061 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.0 -31.7 71.3 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.153 -0.967 . . . . 0.0 110.975 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.432 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 51.4 mt-30 -65.64 -46.48 79.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.115 -0.991 . . . . 0.0 110.761 -179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.713 ' O ' HG12 ' A' ' 66' ' ' VAL . 38.4 t80 -56.46 -67.49 0.3 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 111.007 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.606 HD12 ' C ' ' A' ' 63' ' ' LEU . 4.2 pp -59.17 -12.98 5.93 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.227 -0.921 . . . . 0.0 110.98 -179.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 t -88.59 -23.41 23.12 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.036 -1.04 . . . . 0.0 109.97 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 3.6 mm100 -97.67 -44.34 6.81 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.461 -0.774 . . . . 0.0 109.829 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 62' ' ' PHE . 1.8 p -98.45 91.67 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 109.935 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.451 ' C ' HG12 ' A' ' 68' ' ' ILE . 19.1 pttp -65.29 -177.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.44 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.952 HG22 ' HD2' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -151.09 149.92 26.12 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.286 -0.884 . . . . 0.0 109.52 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.952 ' HD2' HG22 ' A' ' 68' ' ' ILE . 44.8 Cg_endo -49.7 -177.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.807 1.425 . . . . 0.0 110.455 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.74 -3.42 42.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.294 -0.879 . . . . 0.0 110.683 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -23.15 29.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.096 -1.002 . . . . 0.0 109.934 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 1.074 HD12 ' O ' ' A' ' 8' ' ' LYS . 2.2 tp -94.58 106.34 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.393 -0.817 . . . . 0.0 110.212 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.5 m -97.34 156.37 16.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.049 -1.032 . . . . 0.0 109.483 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.575 HG21 ' CG1' ' A' ' 5' ' ' VAL . 5.8 p -143.85 138.1 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 118.883 -1.127 . . . . 0.0 111.774 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 -179.22 3.94 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.899 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.6 p -128.33 155.67 44.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.214 -0.929 . . . . 0.0 110.124 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.34 -178.31 41.09 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -147.5 133.34 19.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.396 -1.061 . . . . 0.0 109.909 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.628 ' HG2' HD11 ' B' ' 4' ' ' ILE . 5.0 mtm -118.66 -179.91 3.94 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.242 -0.911 . . . . 0.0 110.55 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' B' ' 76' ' ' THR . 21.6 p -142.41 110.15 5.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.307 -0.871 . . . . 0.0 109.973 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.1 tt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.301 -179.767 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.157 0.503 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.3 m -70.47 121.78 84.51 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.3 Cg_endo -68.84 156.63 64.78 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 124.149 1.605 . . . . 0.0 110.512 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.628 HD11 ' HG2' ' A' ' 79' ' ' MET . 5.1 pt -142.5 168.9 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.349 -0.844 . . . . 0.0 109.887 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.617 HG12 HG21 ' B' ' 74' ' ' VAL . 5.3 t -145.76 124.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.206 -0.934 . . . . 0.0 110.269 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.494 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.0 OUTLIER -105.64 119.17 38.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.215 -0.928 . . . . 0.0 110.341 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.73 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.3 mp -116.56 147.32 41.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.3 -0.875 . . . . 0.0 110.198 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 1.061 ' O ' HD12 ' B' ' 72' ' ' ILE . 11.6 tttt -142.4 168.71 19.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 110.439 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.434 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 151.61 -165.96 30.65 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 130.84 44.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -1.124 . . . . 0.0 110.196 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.28 -38.79 42.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.868 . . . . 0.0 110.67 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -66.56 -47.1 73.86 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.185 -0.947 . . . . 0.0 110.515 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.478 ' O ' HD13 ' B' ' 17' ' ' LEU . 7.1 m -58.01 -28.32 64.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.21 -0.931 . . . . 0.0 110.539 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.675 HD21 HD13 ' B' ' 72' ' ' ILE . 77.3 mt -77.37 -26.95 52.37 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 0.0 110.358 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -59.36 -39.67 84.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.194 -0.941 . . . . 0.0 110.343 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.487 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 0.8 OUTLIER -70.2 -34.22 72.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.216 -0.927 . . . . 0.0 110.367 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' B' ' 13' ' ' THR . 6.1 mp -58.8 -51.66 69.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.131 -0.98 . . . . 0.0 110.466 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.487 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 1.3 ttp-105 -46.16 -32.36 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.92 . . . . 0.0 110.098 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.487 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 48.8 t80 -64.91 -33.25 75.56 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -74.53 -30.19 61.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.264 -0.897 . . . . 0.0 110.503 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 11.3 m-30 -66.51 -21.58 66.17 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.208 -0.932 . . . . 0.0 110.459 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 29.2 mmtp -63.5 -36.24 83.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.255 -0.903 . . . . 0.0 110.592 -179.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -75.12 -40.94 59.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.218 -0.926 . . . . 0.0 110.411 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.621 ' HB3' HD12 ' B' ' 27' ' ' LEU . 15.8 m-70 -95.07 36.28 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.464 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.593 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 31.8 p -57.38 -17.84 14.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.133 -0.98 . . . . 0.0 110.485 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.92 -3.28 42.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.111 -0.993 . . . . 0.0 110.396 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.621 HD12 ' HB3' ' B' ' 24' ' ' HIS . 10.9 mt -92.32 -6.22 50.69 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.556 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.593 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 20.7 p90 -145.04 -178.09 5.87 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.202 -0.936 . . . . 0.0 109.635 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 48.0 m -96.44 -69.19 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.91 -1.119 . . . . 0.0 110.589 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.46 20.99 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.955 -1.091 . . . . 0.0 109.065 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.678 ' O ' HG13 ' B' ' 31' ' ' VAL . 14.3 p -91.37 113.32 26.75 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.938 0 O-C-N 121.712 -0.617 . . . . 0.0 110.39 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.443 ' OG ' ' HB ' ' B' ' 50' ' ' THR . 70.7 p -53.08 152.55 4.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.006 -1.059 . . . . 0.0 109.56 179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . 0.483 ' OG ' ' HB2' ' A' ' 35' ' ' TRP . 0.9 OUTLIER -60.77 154.45 21.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.014 -1.054 . . . . 0.0 109.98 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -67.63 130.23 42.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.161 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.453 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 44.1 p-90 -146.09 176.04 10.02 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.313 -0.867 . . . . 0.0 109.929 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' B' ' 47' ' ' ALA . 53.7 t-80 -162.55 178.05 8.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.427 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.476 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 79.6 m95 -78.5 123.78 27.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.276 -0.89 . . . . 0.0 110.067 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 1.7 m . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.32 -0.863 . . . . 0.0 109.869 -179.868 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.485 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.594 0 CA-C-O 121.311 0.577 . . . . 0.0 110.008 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.73 HG23 ' O ' ' B' ' 7' ' ' LEU . 70.2 mt -142.12 144.29 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.18 -0.95 . . . . 0.0 110.318 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . 0.542 HG12 ' N ' ' B' ' 50' ' ' THR . 70.8 t -116.65 169.16 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 0.0 110.498 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.542 ' N ' HG12 ' B' ' 49' ' ' VAL . 17.2 m -146.04 152.96 40.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.295 -0.878 . . . . 0.0 109.804 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -136.01 128.47 30.43 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.132 -0.98 . . . . 0.0 110.232 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.417 ' OG1' ' CZ3' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.93 39.92 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.208 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.541 ' CD2' ' HA ' ' B' ' 59' ' ' ARG . 38.3 m-85 -112.31 147.69 35.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.264 -0.898 . . . . 0.0 110.034 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -93.45 -3.18 53.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.822 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . 0.413 ' OG ' ' HB2' ' B' ' 58' ' ' GLN . 98.8 p -157.44 121.38 4.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.015 -1.053 . . . . 0.0 110.372 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.479 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 2.3 mt-10 -46.99 -42.18 17.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.314 -0.867 . . . . 0.0 109.978 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . 0.429 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 16.1 t-105 -53.94 -55.83 23.38 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.413 ' HB2' ' OG ' ' B' ' 55' ' ' SER . 17.1 tt0 -59.23 -31.06 68.71 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.408 -0.807 . . . . 0.0 110.52 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.541 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 0.0 OUTLIER -59.41 -54.7 43.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.18 -0.95 . . . . 0.0 110.96 -179.645 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . 0.418 ' O ' ' CB ' ' B' ' 64' ' ' SER . 19.6 t70 -61.12 -31.3 71.01 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.174 -0.954 . . . . 0.0 110.893 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.442 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 51.3 mt-30 -65.76 -46.55 78.39 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.116 -0.99 . . . . 0.0 110.668 -179.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.705 ' O ' HG12 ' B' ' 66' ' ' VAL . 41.5 t80 -56.43 -67.84 0.27 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.242 -0.911 . . . . 0.0 111.04 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.615 ' C ' HD12 ' B' ' 63' ' ' LEU . 4.1 pp -59.14 -12.93 5.78 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.306 -0.872 . . . . 0.0 110.792 -179.094 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 11.2 t -88.46 -23.36 23.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.172 -0.955 . . . . 0.0 109.901 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 3.5 mm-40 -98.2 -44.63 6.51 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.444 -0.785 . . . . 0.0 110.02 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.705 HG12 ' O ' ' B' ' 62' ' ' PHE . 1.9 p -98.12 90.9 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.359 -0.838 . . . . 0.0 110.008 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.456 ' C ' HG12 ' B' ' 68' ' ' ILE . 19.0 pttp -64.48 -176.88 0.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.413 -0.804 . . . . 0.0 110.48 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.919 HG22 ' HD2' ' B' ' 69' ' ' PRO . 0.1 OUTLIER -151.44 149.93 25.55 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.405 -0.809 . . . . 0.0 109.682 -179.847 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.919 ' HD2' HG22 ' B' ' 68' ' ' ILE . 45.3 Cg_endo -49.35 -178.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.779 1.41 . . . . 0.0 110.655 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -4.0 43.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.288 -0.882 . . . . 0.0 110.581 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.63 -23.29 29.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.151 -0.968 . . . . 0.0 110.078 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 1.061 HD12 ' O ' ' B' ' 8' ' ' LYS . 1.9 tp -94.47 106.59 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 110.112 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 26.8 m -97.35 156.06 16.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.044 -1.035 . . . . 0.0 109.408 179.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.617 HG21 HG12 ' B' ' 5' ' ' VAL . 6.0 p -143.91 138.39 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.85 -1.14 . . . . 0.0 111.63 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -179.37 3.98 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.009 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . 0.436 ' O ' ' OG ' ' A' ' 80' ' ' SER . 5.5 p -128.19 155.46 44.47 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.01 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.72 -178.32 41.31 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -147.5 133.52 19.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.336 -1.097 . . . . 0.0 110.05 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.605 ' HG2' HD11 ' A' ' 4' ' ' ILE . 5.0 mtm -118.81 179.74 4.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.341 -0.85 . . . . 0.0 110.323 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 21.6 p -142.07 110.17 5.91 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.379 -0.825 . . . . 0.0 109.88 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.402 HG22 ' H ' ' B' ' 81' ' ' ILE . 13.8 tt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.384 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.4 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.222 0.534 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.43 142.65 89.51 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.262 -0.899 . . . . 0.0 110.107 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.46 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 45.3 Cg_endo -92.5 137.22 1.6 Allowed 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.97 1.511 . . . . 0.0 110.227 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.527 HG21 ' SD ' ' A' ' 79' ' ' MET . 1.0 OUTLIER -142.8 176.05 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.861 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.557 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 12.4 p -146.11 153.69 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.199 -0.938 . . . . 0.0 110.466 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.591 ' HD2' HG23 ' A' ' 50' ' ' THR . 0.2 OUTLIER -133.75 108.89 8.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.481 -0.762 . . . . 0.0 109.765 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.656 ' O ' HG23 ' A' ' 48' ' ' ILE . 2.4 pp -120.89 162.44 19.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.685 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.598 ' O ' HG23 ' A' ' 72' ' ' ILE . 31.3 pttt -139.58 166.4 24.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.317 -0.864 . . . . 0.0 110.22 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 167.11 178.72 39.65 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -65.34 136.4 56.48 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.304 -1.116 . . . . 0.0 110.508 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.08 -24.43 2.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.232 -0.917 . . . . 0.0 110.18 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -81.37 -51.38 8.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -57.86 -16.73 12.76 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.286 -0.883 . . . . 0.0 109.905 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 mt -90.89 -28.98 17.77 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -0.838 . . . . 0.0 110.135 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -60.19 -48.83 80.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.277 -0.889 . . . . 0.0 110.675 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.2 t -70.02 -34.91 73.89 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 110.763 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.73 -48.1 82.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.148 -0.97 . . . . 0.0 110.56 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.548 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 72.0 ttt-85 -47.69 -32.51 5.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.648 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -64.12 -25.81 68.26 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.945 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -73.68 -32.93 64.21 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.206 -0.934 . . . . 0.0 109.631 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.57 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 7.2 m-30 -66.72 -8.19 26.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.37 -0.831 . . . . 0.0 110.191 179.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.7 mmtt -63.06 -49.82 73.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.157 -0.965 . . . . 0.0 109.856 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -75.29 -25.93 58.33 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.248 -0.907 . . . . 0.0 109.772 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.472 ' HA ' HD13 ' A' ' 27' ' ' LEU . 18.1 m170 -95.27 29.61 2.45 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.377 -0.827 . . . . 0.0 110.018 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 p -57.26 -19.59 22.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.111 -0.993 . . . . 0.0 110.177 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.7 t -97.09 9.32 42.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 24' ' ' HIS . 4.2 mp -92.38 -33.07 14.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.123 -0.986 . . . . 0.0 110.628 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.5 p90 -118.76 168.88 10.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.964 -1.085 . . . . 0.0 110.255 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.67 -31.59 11.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.571 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.77 116.23 2.52 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.152 -0.967 . . . . 0.0 110.582 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.767 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.3 p -90.11 101.57 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.157 -0.964 . . . . 0.0 110.268 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.609 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 54.9 p -50.41 153.02 1.67 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.135 -0.978 . . . . 0.0 110.484 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.477 ' OG ' ' HB2' ' B' ' 35' ' ' TRP . 91.5 p -61.27 -96.43 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.274 -0.891 . . . . 0.0 110.506 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.471 ' N ' ' OG ' ' A' ' 33' ' ' SER . 3.2 m -171.55 125.19 0.6 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.414 -0.804 . . . . 0.0 110.036 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.56 ' CE3' ' HB2' ' B' ' 32' ' ' SER . 33.6 p-90 -147.09 -168.61 3.09 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.374 -0.829 . . . . 0.0 110.053 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.532 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . 82.6 t60 -162.64 171.14 17.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.26 -0.9 . . . . 0.0 110.183 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.505 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 4.4 m95 -79.85 99.11 7.37 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.15 -0.969 . . . . 0.0 110.054 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.478 ' O ' HG13 ' B' ' 31' ' ' VAL . 2.3 m . . . . . 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 110.013 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.539 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.617 0 CA-C-O 121.188 0.518 . . . . 0.0 110.168 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.656 HG23 ' O ' ' A' ' 7' ' ' LEU . 64.4 mt -142.42 162.13 18.92 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.177 -0.952 . . . . 0.0 110.102 -179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.6 t -135.95 167.98 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.702 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.591 HG23 ' HD2' ' A' ' 6' ' ' HIS . 82.9 m -145.99 153.81 41.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.603 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.557 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 0.5 OUTLIER -136.33 136.04 39.37 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.045 -1.035 . . . . 0.0 110.219 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.571 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 0.0 OUTLIER -96.61 125.28 40.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.444 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.46 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 38.1 m-85 -108.83 147.37 32.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 110.133 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -95.37 -16.92 22.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -140.26 126.84 20.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.184 -0.947 . . . . 0.0 110.296 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 4.3 mt-10 -53.99 -42.97 69.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.244 -0.91 . . . . 0.0 110.23 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 t-105 -53.58 -48.31 69.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -58.84 -36.31 74.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.371 -0.831 . . . . 0.0 110.088 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.773 ' NH2' HG22 ' A' ' 76' ' ' THR . 2.2 tmt_? -59.45 -45.51 91.4 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -60.99 -38.25 85.36 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.137 -0.977 . . . . 0.0 110.674 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -65.51 -39.23 91.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 110.53 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.708 ' O ' HG22 ' A' ' 66' ' ' VAL . 30.5 t80 -56.24 -65.2 0.65 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.356 -0.84 . . . . 0.0 111.036 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.739 HD12 ' C ' ' A' ' 63' ' ' LEU . 4.6 pp -59.64 -10.31 3.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.221 -0.924 . . . . 0.0 110.841 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . 0.512 ' N ' HD12 ' A' ' 63' ' ' LEU . 4.5 t -92.41 -23.61 19.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.098 -1.001 . . . . 0.0 110.699 -179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -95.5 -28.25 14.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.077 -1.015 . . . . 0.0 110.716 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 62' ' ' PHE . 3.5 m -109.37 75.07 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.044 -1.035 . . . . 0.0 110.138 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -50.83 111.57 0.57 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.288 -0.882 . . . . 0.0 110.229 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.499 HG23 ' HB ' ' A' ' 72' ' ' ILE . 0.5 OUTLIER -87.62 139.28 31.47 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 110.065 -179.647 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 68' ' ' ILE . 46.2 Cg_endo -56.5 179.01 0.11 Allowed 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.211 1.637 . . . . 0.0 110.56 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -86.36 -0.62 56.3 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.338 -0.851 . . . . 0.0 110.195 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.0 p -84.42 -30.5 25.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.282 -0.886 . . . . 0.0 109.765 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.598 HG23 ' O ' ' A' ' 8' ' ' LYS . 50.8 mt -94.34 114.76 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.013 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.539 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 7.0 m -95.53 146.08 24.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.195 -0.941 . . . . 0.0 109.933 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.526 ' CG2' ' CG2' ' A' ' 5' ' ' VAL . 8.2 p -145.2 154.32 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.129 -0.982 . . . . 0.0 110.749 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.99 -179.23 5.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 109.876 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.773 HG22 ' NH2' ' A' ' 59' ' ' ARG . 52.4 p -107.09 163.81 12.68 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.381 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -165.45 -177.86 38.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -147.9 144.15 27.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.201 -1.176 . . . . 0.0 110.333 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.527 ' SD ' HG21 ' A' ' 4' ' ' ILE . 97.2 mtp -115.29 172.46 7.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.265 -0.897 . . . . 0.0 110.147 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.473 ' HB3' ' O ' ' B' ' 76' ' ' THR . 2.2 t -132.72 101.76 5.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.937 . . . . 0.0 110.483 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.41 HG23 ' O ' ' A' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.126 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mtp . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.246 0.546 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.97 143.81 92.22 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.266 -0.896 . . . . 0.0 110.27 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.462 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 46.3 Cg_endo -93.4 137.14 1.29 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 O-C-N 124.03 1.542 . . . . 0.0 110.362 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.507 HG21 ' SD ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -143.13 176.73 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.391 -0.818 . . . . 0.0 110.025 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 74' ' ' VAL . 12.3 p -146.44 154.04 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 110.413 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.566 ' HD2' HG23 ' B' ' 50' ' ' THR . 0.2 OUTLIER -133.92 108.42 8.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 0.0 109.667 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.648 ' O ' HG23 ' B' ' 48' ' ' ILE . 2.5 pp -120.55 162.45 19.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.963 . . . . 0.0 110.687 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.616 ' O ' HG23 ' B' ' 72' ' ' ILE . 31.9 pttt -139.69 166.31 24.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.26 -0.9 . . . . 0.0 110.256 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 167.17 178.36 39.45 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -65.02 136.89 57.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.42 -1.047 . . . . 0.0 110.405 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.38 -25.13 3.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.325 -0.859 . . . . 0.0 110.117 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -80.52 -51.61 8.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.317 -0.864 . . . . 0.0 110.188 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 18.6 m -57.87 -16.54 12.14 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.248 -0.907 . . . . 0.0 110.041 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.6 mt -91.16 -28.74 17.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 110.237 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 18.0 ttmt -60.15 -48.67 80.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.29 -0.881 . . . . 0.0 110.638 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -70.15 -34.98 73.7 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.172 -0.955 . . . . 0.0 110.865 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.65 -48.12 82.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.064 -1.023 . . . . 0.0 110.505 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.559 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 71.4 ttt-85 -47.63 -32.64 5.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.593 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -64.28 -25.17 67.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -0.982 . . . . 0.0 109.953 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -74.69 -32.71 62.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.318 -0.864 . . . . 0.0 109.5 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 7.5 m-30 -66.65 -8.17 25.65 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 110.117 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -63.14 -50.09 71.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -75.14 -25.74 58.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.779 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.489 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 18.1 m170 -95.34 29.34 2.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.366 -0.834 . . . . 0.0 110.14 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 14.3 p -57.04 -19.73 20.6 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.104 -0.997 . . . . 0.0 110.208 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -97.06 9.54 41.82 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.851 . . . . 0.0 110.209 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.489 ' HB2' ' O ' ' B' ' 24' ' ' HIS . 4.2 mp -92.31 -34.13 14.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.22 -0.925 . . . . 0.0 110.564 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -117.9 168.92 10.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.005 -1.06 . . . . 0.0 110.417 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.71 -31.48 11.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.312 -0.867 . . . . 0.0 110.828 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.589 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.67 116.47 2.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.054 -1.029 . . . . 0.0 110.58 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.778 ' O ' HG13 ' B' ' 31' ' ' VAL . 12.0 p -90.27 101.12 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.116 -0.99 . . . . 0.0 110.333 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.56 ' HB2' ' CE3' ' A' ' 35' ' ' TRP . 60.0 p -50.38 152.51 1.82 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.081 -1.012 . . . . 0.0 110.376 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' B' ' 34' ' ' THR . 85.6 p -61.23 -95.93 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.884 . . . . 0.0 110.5 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.514 ' N ' ' OG ' ' B' ' 33' ' ' SER . 3.2 m -171.64 125.45 0.59 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.461 -0.774 . . . . 0.0 110.054 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.609 ' CE3' ' HB2' ' A' ' 32' ' ' SER . 36.1 p-90 -147.11 -168.77 3.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.375 -0.828 . . . . 0.0 110.075 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.52 ' HB2' ' HA ' ' B' ' 47' ' ' ALA . 82.2 t60 -162.58 170.77 18.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.146 -0.971 . . . . 0.0 110.079 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.498 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 4.5 m95 -79.91 98.34 7.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.112 -0.992 . . . . 0.0 110.154 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . 0.53 ' O ' ' CG1' ' A' ' 31' ' ' VAL . 2.3 m . . . . . 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 0.0 110.189 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.532 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 121.251 0.548 . . . . 0.0 110.277 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.648 HG23 ' O ' ' B' ' 7' ' ' LEU . 64.2 mt -142.38 162.43 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.227 -0.921 . . . . 0.0 110.12 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 t -136.49 168.05 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.098 -1.001 . . . . 0.0 110.725 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.566 HG23 ' HD2' ' B' ' 6' ' ' HIS . 78.4 m -145.94 153.87 41.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.439 -0.788 . . . . 0.0 109.677 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.544 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 0.5 OUTLIER -136.52 135.89 38.89 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.08 -1.013 . . . . 0.0 110.295 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.589 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 0.0 OUTLIER -96.59 124.98 40.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.505 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.462 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 40.5 m-85 -108.71 147.46 31.92 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.344 -0.848 . . . . 0.0 110.076 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -95.29 -17.66 21.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.094 -1.004 . . . . 0.0 110.273 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -139.22 127.33 22.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.403 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 4.2 mt-10 -54.37 -42.63 70.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 110.264 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -53.7 -48.45 69.55 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.209 -0.932 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -58.94 -36.04 74.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.098 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.776 ' NH2' HG22 ' B' ' 76' ' ' THR . 1.8 tmt_? -59.2 -45.73 90.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -0.847 . . . . 0.0 110.915 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.02 -37.94 84.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.027 -1.046 . . . . 0.0 110.774 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -65.67 -38.96 90.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.15 -0.968 . . . . 0.0 110.448 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.711 ' O ' HG22 ' B' ' 66' ' ' VAL . 31.4 t80 -56.25 -65.17 0.65 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.227 -0.921 . . . . 0.0 110.987 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.733 ' C ' HD12 ' B' ' 63' ' ' LEU . 4.6 pp -59.59 -11.54 5.0 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.292 -0.88 . . . . 0.0 110.951 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . 0.526 ' N ' HD12 ' B' ' 63' ' ' LEU . 4.8 t -91.11 -23.48 20.28 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.014 -1.054 . . . . 0.0 110.663 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -95.57 -28.58 14.78 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.093 -1.005 . . . . 0.0 110.769 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.711 HG22 ' O ' ' B' ' 62' ' ' PHE . 3.5 m -109.02 74.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.095 -1.003 . . . . 0.0 110.231 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -50.12 111.67 0.56 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.382 -0.823 . . . . 0.0 110.108 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.496 HG23 ' HB ' ' B' ' 72' ' ' ILE . 0.5 OUTLIER -87.67 139.56 31.41 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.085 -1.01 . . . . 0.0 110.035 -179.638 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.445 ' HD2' HG23 ' B' ' 68' ' ' ILE . 47.3 Cg_endo -56.85 178.92 0.12 Allowed 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 124.156 1.608 . . . . 0.0 110.518 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -86.07 -0.8 56.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 58.8 p -84.41 -30.29 25.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.19 -0.944 . . . . 0.0 109.7 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.616 HG23 ' O ' ' B' ' 8' ' ' LYS . 47.9 mt -94.51 114.68 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.394 -0.816 . . . . 0.0 110.079 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . 0.54 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.0 m -95.42 146.23 24.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 110.002 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 5' ' ' VAL . 8.4 p -145.22 154.34 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.159 -0.963 . . . . 0.0 110.857 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.43 -179.5 6.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.493 -0.754 . . . . 0.0 109.89 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . 0.776 HG22 ' NH2' ' B' ' 59' ' ' ARG . 54.2 p -106.73 163.87 12.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.196 -0.94 . . . . 0.0 110.344 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -165.47 -177.52 37.87 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -148.24 144.23 27.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.151 -1.205 . . . . 0.0 110.347 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.507 ' SD ' HG21 ' B' ' 4' ' ' ILE . 96.6 mtp -115.18 172.95 6.76 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.283 -0.885 . . . . 0.0 110.108 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.412 ' O ' HG23 ' B' ' 81' ' ' ILE . 2.2 t -133.21 102.36 5.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 0.0 110.312 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.412 HG23 ' O ' ' B' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mmm . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 121.306 0.574 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.522 ' O ' ' CG ' ' A' ' 79' ' ' MET . 0.3 OUTLIER -103.14 101.31 21.2 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 110.186 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.503 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -56.37 164.42 5.42 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.904 1.476 . . . . 0.0 110.243 -179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' A' ' 77' ' ' GLY . 1.3 pt -144.01 125.39 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.172 -0.955 . . . . 0.0 110.187 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.542 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 5.6 p -94.34 132.56 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.211 -0.931 . . . . 0.0 110.246 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.579 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -105.28 126.23 51.87 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.767 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.894 ' CD1' HG23 ' A' ' 72' ' ' ILE . 13.0 tp -115.01 133.65 55.86 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.16 -0.962 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.521 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.1 tttt -141.15 166.38 24.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.335 -0.853 . . . . 0.0 109.974 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.521 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.32 -171.55 32.22 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.751 -1.339 . . . . 0.0 109.751 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.0 136.08 56.38 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -1.158 . . . . 0.0 110.39 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.537 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.81 -48.41 59.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.303 -0.873 . . . . 0.0 110.652 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.8 -56.17 13.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.082 -1.011 . . . . 0.0 110.487 -179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.4 m -58.19 -26.0 62.26 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.164 -0.96 . . . . 0.0 110.786 -179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.816 ' HA ' HD12 ' A' ' 17' ' ' LEU . 56.1 mt -71.86 -31.89 66.92 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.117 -0.989 . . . . 0.0 110.379 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -59.69 -42.7 93.53 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.216 -0.928 . . . . 0.0 110.567 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.4 -37.53 74.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.212 -0.93 . . . . 0.0 111.002 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 14' ' ' LEU . 42.8 mt -58.8 -55.44 35.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.071 -1.018 . . . . 0.0 110.594 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttp85 -45.59 -21.55 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.241 -0.912 . . . . 0.0 110.919 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 17' ' ' LEU . 67.0 t80 -64.41 -59.33 4.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.083 -1.011 . . . . 0.0 110.678 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.5 mtt-85 -68.16 -14.72 63.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 0.0 110.417 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.62 -41.05 88.98 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.253 -0.904 . . . . 0.0 110.573 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -63.51 -25.13 68.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.171 -0.955 . . . . 0.0 110.668 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -75.28 -38.66 60.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 110.575 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.877 ' HB3' HD12 ' A' ' 27' ' ' LEU . 23.1 m-70 -94.73 45.25 1.11 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.399 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.604 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 20.0 p -57.32 -16.1 7.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.349 -0.844 . . . . 0.0 110.229 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.573 HG23 ' SG ' ' A' ' 25' ' ' CYS . 65.3 p -96.85 3.62 52.11 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.454 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.877 HD12 ' HB3' ' A' ' 24' ' ' HIS . 8.0 mt -91.75 -26.28 18.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 0.0 110.137 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.604 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 44.0 p90 -122.13 174.22 7.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.158 -0.964 . . . . 0.0 109.936 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.6 m -101.0 -36.36 9.05 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.118 -0.989 . . . . 0.0 111.949 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.493 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -160.51 123.99 3.47 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.855 -1.153 . . . . 0.0 110.941 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.614 ' O ' HG13 ' A' ' 31' ' ' VAL . 8.5 p -89.62 120.46 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.176 -0.952 . . . . 0.0 110.049 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.64 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 4.4 p -84.21 150.18 25.64 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.321 -0.862 . . . . 0.0 110.953 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.39 158.52 14.4 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.523 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.5 m -67.77 134.58 51.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.021 -1.049 . . . . 0.0 109.962 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.668 ' CD2' ' O ' ' A' ' 35' ' ' TRP . 46.9 p-90 -145.49 120.7 10.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.106 -0.996 . . . . 0.0 109.917 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.885 ' CD2' HG22 ' A' ' 38' ' ' THR . 0.3 OUTLIER -79.02 161.29 26.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.212 -0.93 . . . . 0.0 110.614 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.585 ' CE3' ' HA ' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -78.62 55.5 1.66 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.929 179.761 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.885 HG22 ' CD2' ' A' ' 36' ' ' HIS . 6.0 t . . . . . 0 N--CA 1.492 1.65 0 O-C-N 121.197 -0.939 . . . . 0.0 110.228 -179.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.602 0 CA-C-O 121.284 0.564 . . . . 0.0 110.118 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.813 HG23 ' O ' ' A' ' 7' ' ' LEU . 25.9 mt -141.5 140.97 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.162 -0.961 . . . . 0.0 110.599 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.447 HG12 HD11 ' A' ' 51' ' ' LEU . 48.5 t -121.94 117.81 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.386 -0.821 . . . . 0.0 109.933 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.766 ' C ' HD12 ' A' ' 51' ' ' LEU . 39.2 m -94.15 154.63 17.48 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.192 -0.943 . . . . 0.0 110.49 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.766 HD12 ' C ' ' A' ' 50' ' ' THR . 5.6 mp -135.91 134.72 39.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.234 -0.916 . . . . 0.0 109.889 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.527 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.85 127.49 42.88 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.324 -0.86 . . . . 0.0 110.757 -179.44 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.503 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 15.9 m-85 -109.13 147.84 31.82 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.459 -0.775 . . . . 0.0 109.976 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -88.22 -10.09 50.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.23 -0.919 . . . . 0.0 110.765 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.19 132.42 10.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.116 -0.99 . . . . 0.0 110.319 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 30.1 mm-40 -54.47 -38.15 66.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.304 -0.873 . . . . 0.0 110.054 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -53.65 -53.54 50.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.025 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -57.07 -27.23 61.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.421 -0.8 . . . . 0.0 110.256 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.462 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 25.0 ttt-85 -59.62 -49.57 77.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.182 -0.949 . . . . 0.0 110.257 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -61.37 -33.09 73.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.364 -0.835 . . . . 0.0 110.914 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -65.19 -49.59 69.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.988 -1.07 . . . . 0.0 110.158 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.867 ' CE2' HG21 ' A' ' 66' ' ' VAL . 0.6 OUTLIER -55.4 -41.43 72.69 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.214 -0.929 . . . . 0.0 109.639 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.492 HD23 HD11 ' A' ' 68' ' ' ILE . 2.6 mt -59.77 -24.61 64.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.426 -0.796 . . . . 0.0 110.374 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.7 p -91.77 -19.01 23.04 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.165 -0.959 . . . . 0.0 110.32 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.74 -17.26 20.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.21 -0.931 . . . . 0.0 110.141 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.867 HG21 ' CE2' ' A' ' 62' ' ' PHE . 30.9 t -102.17 97.46 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.319 -0.863 . . . . 0.0 110.329 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.524 ' CD ' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -56.62 104.52 0.15 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.224 -0.922 . . . . 0.0 110.15 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.609 HG23 ' HB ' ' A' ' 72' ' ' ILE . 7.0 mt -89.85 136.44 29.23 Favored Pre-proline 0 C--N 1.301 -1.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.278 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.548 ' HG2' HD13 ' A' ' 72' ' ' ILE . 45.8 Cg_endo -76.76 -158.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.034 1.544 . . . . 0.0 110.214 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.525 ' O ' HG23 ' A' ' 71' ' ' THR . 39.0 mttp -100.92 45.38 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.491 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 70' ' ' LYS . 0.7 OUTLIER -154.69 -10.87 0.13 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.063 -1.023 . . . . 0.0 112.1 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.894 HG23 ' CD1' ' A' ' 7' ' ' LEU . 1.2 mp -94.2 113.74 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 120.596 -1.315 . . . . 0.0 109.962 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.5 m -95.59 144.38 26.09 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.104 -0.997 . . . . 0.0 110.449 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.461 HG12 ' N ' ' A' ' 75' ' ' SER . 24.7 t -90.15 167.09 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 111.085 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.579 ' HB2' ' CB ' ' A' ' 6' ' ' HIS . 1.2 m -144.39 164.45 30.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.671 -0.643 . . . . 0.0 110.895 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.7 p -133.93 156.22 48.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.438 -0.788 . . . . 0.0 109.282 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' A' ' 4' ' ' ILE . . . 176.11 138.58 2.9 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -92.57 140.56 29.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.129 -1.218 . . . . 0.0 110.255 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.614 ' CE ' HD12 ' A' ' 81' ' ' ILE . 2.8 ppp? -126.91 168.55 14.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.138 -0.976 . . . . 0.0 110.309 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.485 ' O ' HG13 ' A' ' 81' ' ' ILE . 0.5 OUTLIER -148.86 108.97 4.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.243 -0.91 . . . . 0.0 110.25 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.614 HD12 ' CE ' ' A' ' 79' ' ' MET . 27.7 mt . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.194 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.4 ' HE3' ' HB3' ' B' ' 1' ' ' MET . 3.2 mmm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.278 0.561 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . 0.546 ' O ' ' CG ' ' B' ' 79' ' ' MET . 0.3 OUTLIER -102.84 100.52 16.86 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.216 -0.927 . . . . 0.0 110.285 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.3 Cg_endo -55.5 164.58 4.01 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 O-C-N 123.974 1.513 . . . . 0.0 110.325 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' B' ' 77' ' ' GLY . 1.3 pt -144.29 125.1 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.936 . . . . 0.0 110.227 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.536 ' CG1' ' HB2' ' B' ' 51' ' ' LEU . 5.5 p -94.23 132.41 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.13 -0.981 . . . . 0.0 110.303 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.584 ' CB ' ' HB2' ' B' ' 75' ' ' SER . 0.0 OUTLIER -105.07 126.5 52.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 109.9 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.889 ' CD1' HG23 ' B' ' 72' ' ' ILE . 13.4 tp -115.34 133.57 55.91 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.089 -1.007 . . . . 0.0 110.591 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.532 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 8.7 tttt -141.2 166.47 24.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.326 -0.859 . . . . 0.0 109.885 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.532 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.53 -171.28 32.36 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.96 136.27 56.62 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.36 -1.083 . . . . 0.0 110.354 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.528 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.7 -49.38 57.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.382 -0.823 . . . . 0.0 110.607 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.11 -56.13 12.15 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.704 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 4.2 m -58.0 -26.85 62.91 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.182 -0.949 . . . . 0.0 110.846 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.835 ' HA ' HD12 ' B' ' 17' ' ' LEU . 60.1 mt -70.98 -31.86 68.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.104 -0.998 . . . . 0.0 110.52 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -59.75 -42.66 93.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.625 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 6.0 t -70.17 -37.32 75.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.195 -0.941 . . . . 0.0 110.837 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.835 HD12 ' HA ' ' B' ' 14' ' ' LEU . 48.7 mt -58.8 -55.81 30.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.252 -0.905 . . . . 0.0 110.708 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ttp85 -45.75 -21.16 0.1 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.88 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' B' ' 17' ' ' LEU . 67.2 t80 -64.58 -60.18 3.42 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.025 -1.047 . . . . 0.0 110.527 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 48.2 mtt-85 -67.48 -14.73 63.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.165 -0.96 . . . . 0.0 110.473 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.64 -40.83 88.87 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.193 -0.942 . . . . 0.0 110.585 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 20.4 mmtp -63.37 -25.45 68.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.26 -0.9 . . . . 0.0 110.677 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.18 -39.04 60.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 110.574 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.864 ' HB3' HD12 ' B' ' 27' ' ' LEU . 23.9 m-70 -94.35 45.12 1.12 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.083 -1.011 . . . . 0.0 110.276 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.623 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 20.9 p -57.14 -15.91 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.212 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.575 HG23 ' SG ' ' B' ' 25' ' ' CYS . 80.4 p -96.86 3.09 52.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.325 -0.859 . . . . 0.0 110.446 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.864 HD12 ' HB3' ' B' ' 24' ' ' HIS . 8.2 mt -91.75 -25.64 18.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.158 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.623 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 44.5 p90 -122.5 173.82 7.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.147 -0.971 . . . . 0.0 109.958 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -100.69 -36.13 9.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.986 -1.071 . . . . 0.0 111.742 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.485 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -160.68 123.93 3.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.845 -1.159 . . . . 0.0 111.059 -179.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.615 ' O ' HG13 ' B' ' 31' ' ' VAL . 8.7 p -89.47 119.95 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.161 -0.962 . . . . 0.0 110.037 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.644 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 3.9 p -83.92 150.82 25.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.298 -0.876 . . . . 0.0 110.832 -179.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.45 158.81 13.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.027 -1.045 . . . . 0.0 109.734 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.0 m -68.01 134.76 51.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.028 -1.045 . . . . 0.0 109.899 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.664 ' O ' ' CD2' ' B' ' 35' ' ' TRP . 46.1 p-90 -145.83 120.6 9.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.101 -1.0 . . . . 0.0 109.937 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.846 ' CD2' HG22 ' B' ' 38' ' ' THR . 0.3 OUTLIER -78.94 161.3 26.78 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.235 -0.915 . . . . 0.0 110.593 -179.646 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.588 ' HA ' ' CE3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -78.65 53.48 1.34 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.259 -0.9 . . . . 0.0 110.165 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . 0.846 HG22 ' CD2' ' B' ' 36' ' ' HIS . 6.6 t . . . . . 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.363 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 121.244 0.545 . . . . 0.0 110.286 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.831 HG23 ' O ' ' B' ' 7' ' ' LEU . 40.8 mt -141.87 140.99 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.2 -0.937 . . . . 0.0 110.617 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . 0.463 HG12 HD11 ' B' ' 51' ' ' LEU . 48.1 t -121.67 117.81 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 0.0 109.943 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.765 ' C ' HD12 ' B' ' 51' ' ' LEU . 34.9 m -93.95 154.32 17.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 110.374 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.765 HD12 ' C ' ' B' ' 50' ' ' THR . 5.7 mp -135.81 134.78 39.27 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 109.804 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.514 ' OG1' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.84 127.59 42.97 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 110.627 -179.542 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.496 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 16.1 m-85 -109.43 148.02 31.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.449 -0.782 . . . . 0.0 109.737 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -88.25 -9.73 51.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.131 -0.981 . . . . 0.0 110.725 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.07 133.01 10.51 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.464 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 28.5 mm-40 -55.31 -38.34 68.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -0.875 . . . . 0.0 109.984 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -53.57 -53.29 53.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.34 -0.85 . . . . 0.0 109.884 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -56.72 -27.99 60.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 110.143 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.464 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 24.0 ttt-85 -59.54 -49.17 78.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.19 -0.944 . . . . 0.0 110.395 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -61.47 -33.02 73.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.242 -0.911 . . . . 0.0 110.899 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -65.37 -49.85 67.74 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.152 -0.968 . . . . 0.0 110.063 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.881 ' CE2' HG21 ' B' ' 66' ' ' VAL . 0.6 OUTLIER -55.52 -41.11 72.69 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.275 -0.891 . . . . 0.0 109.642 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.497 HD23 ' CD1' ' B' ' 68' ' ' ILE . 2.6 mt -59.75 -25.58 64.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.413 -0.804 . . . . 0.0 110.178 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 26.0 p -90.48 -19.5 23.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.62 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.83 -17.1 20.42 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.881 HG21 ' CE2' ' B' ' 62' ' ' PHE . 34.8 t -102.04 96.94 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.211 -0.931 . . . . 0.0 110.374 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . 0.526 ' CD ' ' O ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -56.13 104.32 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 110.254 179.872 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.595 HG23 ' HB ' ' B' ' 72' ' ' ILE . 6.8 mt -89.88 136.88 28.66 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.92 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.553 ' HG2' HD13 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -77.19 -157.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.127 1.593 . . . . 0.0 110.296 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.513 ' O ' HG23 ' B' ' 71' ' ' THR . 39.3 mttp -101.5 45.24 0.98 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 110.368 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . 0.513 HG23 ' O ' ' B' ' 70' ' ' LYS . 0.7 OUTLIER -154.76 -10.72 0.13 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.094 -1.004 . . . . 0.0 112.04 -179.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.889 HG23 ' CD1' ' B' ' 7' ' ' LEU . 1.2 mp -94.38 113.84 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 120.553 -1.342 . . . . 0.0 109.971 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m -95.44 144.24 26.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.037 -1.039 . . . . 0.0 110.351 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.468 HG12 ' N ' ' B' ' 75' ' ' SER . 24.1 t -90.13 167.14 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 111.084 -178.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . 0.584 ' HB2' ' CB ' ' B' ' 6' ' ' HIS . 1.3 m -144.59 163.72 33.06 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.409 0.623 . . . . 0.0 110.955 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.3 p -133.13 156.91 46.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.5 -0.75 . . . . 0.0 109.222 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' B' ' 4' ' ' ILE . . . 175.69 138.72 2.89 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -92.71 140.63 29.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.074 -1.251 . . . . 0.0 110.243 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.586 ' CE ' HD12 ' B' ' 81' ' ' ILE . 2.7 ppp? -126.55 169.38 13.13 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 110.19 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.48 ' O ' HG13 ' B' ' 81' ' ' ILE . 0.5 OUTLIER -149.95 108.77 3.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.216 -0.928 . . . . 0.0 110.127 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.586 HD12 ' CE ' ' B' ' 79' ' ' MET . 27.0 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.686 ' HE2' ' CD2' ' A' ' 78' ' ' PHE . 1.8 mtp . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.116 0.484 . . . . 0.0 110.094 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -98.79 122.34 53.27 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.133 -0.979 . . . . 0.0 110.734 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 46.7 Cg_endo -80.41 164.04 21.65 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 124.023 1.538 . . . . 0.0 109.716 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 4' ' ' ILE . 4.7 pt -143.26 124.0 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.07 -1.018 . . . . 0.0 110.755 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.593 ' O ' HG13 ' A' ' 5' ' ' VAL . 11.2 p -95.14 124.68 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.441 -0.787 . . . . 0.0 110.353 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.495 ' O ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -107.24 127.57 53.65 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.154 -0.966 . . . . 0.0 110.272 179.755 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.802 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.7 OUTLIER -129.29 153.58 47.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.06 -1.025 . . . . 0.0 110.507 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.493 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 1.2 ttpm? -141.85 169.8 16.91 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.179 -0.951 . . . . 0.0 110.2 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.493 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.22 -175.46 31.66 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -65.05 146.47 54.96 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -1.076 . . . . 0.0 110.549 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.959 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.42 -48.64 56.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.343 -0.848 . . . . 0.0 110.421 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.435 ' OD1' ' N ' ' A' ' 12' ' ' ASN . 3.3 m120 -53.93 -48.87 69.78 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.156 -0.965 . . . . 0.0 110.678 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.476 HG21 ' OG1' ' A' ' 71' ' ' THR . 0.2 OUTLIER -58.27 -20.61 43.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.239 -0.913 . . . . 0.0 110.98 -179.604 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.959 HD12 ' HA ' ' A' ' 11' ' ' ALA . 51.5 mt -75.61 -39.41 57.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.059 -1.025 . . . . 0.0 110.607 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -60.29 -26.39 66.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.154 -0.966 . . . . 0.0 110.505 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.52 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 29.1 t -69.94 -54.01 15.27 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.285 -0.885 . . . . 0.0 110.843 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.588 HD11 HG13 ' A' ' 72' ' ' ILE . 42.2 mt -59.19 -53.19 61.13 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.048 -1.033 . . . . 0.0 110.566 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -46.63 -25.63 0.75 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.422 -0.799 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.52 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 39.1 t80 -64.85 -39.95 94.37 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.968 -1.082 . . . . 0.0 110.514 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.26 -23.76 60.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.514 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 10.3 m-30 -66.42 -27.94 68.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.167 -0.958 . . . . 0.0 110.346 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mmtt -63.58 -42.46 98.31 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.238 -0.914 . . . . 0.0 110.151 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 mmtm -75.12 -40.35 59.92 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.323 -0.861 . . . . 0.0 110.353 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.412 ' HB3' HD22 ' A' ' 27' ' ' LEU . 41.5 m-70 -94.91 39.63 1.1 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.228 -0.92 . . . . 0.0 110.446 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 10.1 p -57.5 -14.69 5.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.267 -0.896 . . . . 0.0 110.593 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.8 p -96.77 3.97 52.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.972 . . . . 0.0 110.403 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.412 HD22 ' HB3' ' A' ' 24' ' ' HIS . 3.3 mp -92.28 -22.89 19.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.234 -0.916 . . . . 0.0 110.434 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 37.4 p90 -130.06 -177.1 4.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.191 -0.943 . . . . 0.0 109.799 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.9 m -95.67 -64.23 1.08 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.016 -1.052 . . . . 0.0 110.333 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.52 145.5 18.97 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.785 -1.197 . . . . 0.0 109.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.669 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.4 p -91.77 102.6 13.69 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.634 -0.666 . . . . 0.0 110.418 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.47 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 2.6 p -52.35 154.52 2.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.08 -1.013 . . . . 0.0 109.598 179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 p -60.56 158.77 11.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.146 -0.971 . . . . 0.0 110.07 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -67.54 126.25 28.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.142 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.502 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 32.7 p-90 -146.24 173.27 12.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.987 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.502 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 4.9 t60 -162.72 -178.26 6.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.125 -0.984 . . . . 0.0 110.687 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 48.8 m95 -79.37 92.37 5.18 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.469 -0.769 . . . . 0.0 110.158 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 72.6 p . . . . . 0 N--CA 1.492 1.636 0 O-C-N 121.291 -0.881 . . . . 0.0 110.399 -179.762 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.403 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.314 0.578 . . . . 0.0 110.52 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.802 HG23 ' O ' ' A' ' 7' ' ' LEU . 58.0 mt -145.92 150.33 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.333 -0.855 . . . . 0.0 110.435 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.1 t -122.71 170.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 109.805 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.444 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 60.9 m -145.76 156.58 43.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.065 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 mp -136.24 133.11 36.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.223 -0.923 . . . . 0.0 110.31 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.503 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 18.5 m -96.81 130.57 44.05 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.361 -0.837 . . . . 0.0 110.219 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.542 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 11.7 m-85 -110.43 147.99 32.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.178 -0.951 . . . . 0.0 109.987 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -78.9 -3.42 44.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.145 -0.972 . . . . 0.0 110.669 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.49 139.65 1.67 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -56.63 -31.93 64.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.907 . . . . 0.0 109.785 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -55.05 -59.74 4.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.606 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -57.31 -36.76 71.5 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.913 . . . . 0.0 111.152 -178.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 ttp85 -59.26 -40.98 87.74 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.984 -1.072 . . . . 0.0 110.512 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.54 -40.91 96.37 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.273 -0.892 . . . . 0.0 110.745 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -65.66 -40.35 92.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.121 -0.987 . . . . 0.0 110.537 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.625 ' CE2' HG21 ' A' ' 66' ' ' VAL . 9.4 t80 -55.45 -45.5 76.83 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.153 -0.967 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.55 -16.56 25.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.38 -0.825 . . . . 0.0 110.382 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -22.73 19.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.12 -0.987 . . . . 0.0 110.309 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -95.51 -26.52 15.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.038 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.625 HG21 ' CE2' ' A' ' 62' ' ' PHE . 87.0 t -107.09 75.07 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.874 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.78 104.68 0.47 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.197 -0.94 . . . . 0.0 109.886 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.621 HD12 ' H ' ' A' ' 68' ' ' ILE . 0.8 OUTLIER -88.51 134.92 33.26 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.278 -0.889 . . . . 0.0 109.701 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.591 ' HD2' HG22 ' A' ' 68' ' ' ILE . 44.4 Cg_endo -54.77 -160.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.172 1.617 . . . . 0.0 110.561 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 tttm -95.47 2.98 54.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.907 -179.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.476 ' OG1' HG21 ' A' ' 13' ' ' THR . 4.5 p -85.24 -28.59 25.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.076 -1.015 . . . . 0.0 110.774 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.588 HG13 HD11 ' A' ' 17' ' ' LEU . 12.8 mm -94.21 124.57 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.49 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 6.4 t -96.34 138.3 34.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.361 -0.837 . . . . 0.0 110.011 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.01 165.81 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.083 -1.011 . . . . 0.0 111.103 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.495 ' HB2' ' O ' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.23 155.43 45.26 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 110.524 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.6 p -133.67 134.15 42.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.288 -0.882 . . . . 0.0 110.339 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.49 -169.38 25.79 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.599 -1.401 . . . . 0.0 109.599 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.686 ' CD2' ' HE2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -148.07 150.86 34.66 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.378 -1.072 . . . . 0.0 110.165 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HE3' ' A' ' 1' ' ' MET . 26.6 mtp -122.72 158.24 30.56 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.621 ' C ' HD12 ' A' ' 81' ' ' ILE . 0.2 OUTLIER -144.42 111.89 6.06 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 110.114 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.621 HD12 ' C ' ' A' ' 80' ' ' SER . 3.1 mp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.144 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.663 ' HE2' ' CD2' ' B' ' 78' ' ' PHE . 1.7 mtp . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.194 0.521 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 17.6 p -98.52 122.55 53.12 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 0.0 110.678 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.538 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 46.4 Cg_endo -80.69 163.88 21.0 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 123.982 1.517 . . . . 0.0 109.949 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.44 ' O ' HG13 ' B' ' 4' ' ' ILE . 4.9 pt -142.94 123.68 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.108 -0.995 . . . . 0.0 110.813 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.593 ' O ' HG13 ' B' ' 5' ' ' VAL . 11.5 p -94.78 124.94 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 110.319 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' B' ' 75' ' ' SER . 0.0 OUTLIER -107.07 127.16 53.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.197 -0.939 . . . . 0.0 110.192 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.814 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.7 OUTLIER -129.11 153.31 47.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.048 -1.032 . . . . 0.0 110.457 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.495 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 1.2 ttpm? -142.05 169.95 16.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.285 -0.885 . . . . 0.0 110.192 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.495 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.04 -175.27 31.6 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.09 146.01 55.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.29 -1.124 . . . . 0.0 110.583 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.94 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.17 -47.05 54.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.389 -0.819 . . . . 0.0 110.631 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . 0.448 ' OD1' ' N ' ' B' ' 12' ' ' ASN . 3.1 m120 -56.05 -48.32 76.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.13 -0.981 . . . . 0.0 110.649 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.487 HG21 ' OG1' ' B' ' 71' ' ' THR . 0.2 OUTLIER -58.15 -21.28 46.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.221 -0.924 . . . . 0.0 110.69 -179.563 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' B' ' 11' ' ' ALA . 54.5 mt -74.63 -39.81 61.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.99 -1.069 . . . . 0.0 110.647 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.48 -26.17 66.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.144 -0.973 . . . . 0.0 110.619 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.532 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 29.4 t -69.81 -53.77 16.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 110.768 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.583 HD11 HG13 ' B' ' 72' ' ' ILE . 39.8 mt -59.23 -53.55 56.95 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.16 -0.962 . . . . 0.0 110.616 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 0.3 OUTLIER -46.47 -25.51 0.69 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.315 -0.865 . . . . 0.0 111.154 -179.358 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.532 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 40.1 t80 -64.9 -40.35 94.95 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.004 -1.06 . . . . 0.0 110.458 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.18 -23.53 60.44 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.141 -0.975 . . . . 0.0 110.584 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.535 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 10.2 m-30 -66.37 -28.05 68.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.147 -0.971 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 mmtt -63.62 -42.21 98.21 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 110.185 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -75.18 -40.41 59.44 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 110.313 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -95.05 39.78 1.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.192 -0.943 . . . . 0.0 110.405 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.507 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 9.4 p -57.62 -14.83 5.97 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.335 -0.853 . . . . 0.0 110.361 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 29.9 p -96.65 3.91 52.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.219 -0.925 . . . . 0.0 110.303 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 mp -92.25 -23.17 19.41 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.236 -0.915 . . . . 0.0 110.364 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.507 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 39.9 p90 -129.6 -177.0 4.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.203 -0.936 . . . . 0.0 109.783 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -95.33 -64.55 1.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.065 -1.022 . . . . 0.0 110.294 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.58 145.2 18.67 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 120.905 -1.122 . . . . 0.0 109.004 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.653 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.7 p -91.77 102.66 13.75 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.74 -0.6 . . . . 0.0 110.471 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 2.6 p -51.87 154.2 2.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.053 -1.029 . . . . 0.0 109.835 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 2.9 p -60.76 158.82 12.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.015 -1.053 . . . . 0.0 109.898 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.71 126.63 30.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.491 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 33.4 p-90 -146.45 173.2 12.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.26 -0.9 . . . . 0.0 110.022 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.491 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 5.0 t60 -162.66 -178.45 6.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.149 -0.97 . . . . 0.0 110.655 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.503 ' CH2' ' OG1' ' A' ' 52' ' ' THR . 55.0 m95 -79.33 92.97 5.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.444 -0.785 . . . . 0.0 110.076 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 70.7 p . . . . . 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 110.256 -179.827 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.407 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 121.291 0.567 . . . . 0.0 110.586 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.814 HG23 ' O ' ' B' ' 7' ' ' LEU . 56.4 mt -145.99 150.05 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.348 -0.845 . . . . 0.0 110.376 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 2.1 t -122.79 170.13 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.216 -0.927 . . . . 0.0 109.857 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.402 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 73.3 m -145.46 156.53 43.8 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.158 -0.964 . . . . 0.0 110.14 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 mp -136.23 133.65 37.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.889 . . . . 0.0 110.197 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 19.8 m -96.97 130.65 44.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.313 -0.867 . . . . 0.0 110.192 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.538 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 16.3 m-85 -110.06 147.53 33.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.176 -0.953 . . . . 0.0 110.03 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -78.9 -2.95 42.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.727 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.52 139.04 1.21 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.151 -0.968 . . . . 0.0 110.162 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -56.22 -32.31 64.31 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.284 -0.885 . . . . 0.0 109.809 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 17.1 t-105 -54.7 -59.81 4.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 110.612 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.16 -36.73 71.11 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 111.065 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 48.5 ttp85 -59.16 -41.12 87.62 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.937 -1.102 . . . . 0.0 110.627 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.28 -41.25 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.117 -0.99 . . . . 0.0 110.672 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -65.46 -39.78 92.43 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.165 -0.959 . . . . 0.0 110.56 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.607 ' CE2' HG21 ' B' ' 66' ' ' VAL . 10.1 t80 -55.59 -45.96 77.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.141 -0.974 . . . . 0.0 109.624 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.4 mt -59.72 -15.07 17.13 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.453 -0.78 . . . . 0.0 110.459 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -22.95 18.09 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.068 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -95.02 -26.6 16.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.267 -0.896 . . . . 0.0 109.886 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.607 HG21 ' CE2' ' B' ' 62' ' ' PHE . 89.8 t -107.17 75.55 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.229 -0.919 . . . . 0.0 110.106 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 104.79 0.51 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.186 -0.946 . . . . 0.0 109.936 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.6 ' H ' HD12 ' B' ' 68' ' ' ILE . 0.8 OUTLIER -88.62 135.1 32.79 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.287 -0.883 . . . . 0.0 109.834 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.579 ' HD2' HG22 ' B' ' 68' ' ' ILE . 43.7 Cg_endo -54.76 -160.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.052 1.554 . . . . 0.0 110.706 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' B' ' 70' ' ' LYS . 29.7 tttm -94.66 2.6 55.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.193 -0.942 . . . . 0.0 110.837 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . 0.487 ' OG1' HG21 ' B' ' 13' ' ' THR . 4.6 p -85.32 -28.64 25.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.12 -0.988 . . . . 0.0 110.972 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.583 HG13 HD11 ' B' ' 17' ' ' LEU . 12.8 mm -94.32 124.36 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.143 -0.973 . . . . 0.0 111.035 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.3 t -96.18 138.54 33.64 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.001 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -89.87 166.25 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.067 -1.021 . . . . 0.0 111.053 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -142.67 155.29 44.89 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.647 -0.658 . . . . 0.0 110.427 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.2 p -133.3 134.26 43.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.07 -170.14 26.4 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.663 ' CD2' ' HE2' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.86 150.24 33.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.234 -1.156 . . . . 0.0 110.129 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.419 ' O ' ' HB3' ' B' ' 1' ' ' MET . 24.5 mtp -122.18 157.76 30.86 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.901 . . . . 0.0 110.344 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.624 ' C ' HD12 ' B' ' 81' ' ' ILE . 0.2 OUTLIER -144.41 112.21 6.23 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.26 -0.9 . . . . 0.0 109.921 179.812 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.655 ' OXT' HG22 ' B' ' 81' ' ' ILE . 3.0 mp . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.122 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.207 0.527 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.421 ' O ' HG23 ' A' ' 4' ' ' ILE . 23.9 p -125.11 109.85 27.15 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.296 -0.877 . . . . 0.0 110.106 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -50.75 149.48 14.09 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.003 1.528 . . . . 0.0 110.364 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.865 HD11 ' HA3' ' A' ' 77' ' ' GLY . 1.0 OUTLIER -143.49 175.84 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.734 HG13 HG11 ' A' ' 74' ' ' VAL . 78.4 t -145.68 121.11 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.173 -0.955 . . . . 0.0 110.168 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.575 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 0.0 OUTLIER -105.39 125.72 51.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.243 -0.911 . . . . 0.0 110.333 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.579 ' O ' HG23 ' A' ' 48' ' ' ILE . 3.3 mp -117.65 141.38 48.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.275 -0.89 . . . . 0.0 110.072 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.524 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 20.5 tptp -139.09 160.44 39.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.968 . . . . 0.0 110.455 -179.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.524 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 156.75 -156.76 27.43 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . 0.481 ' OD1' ' HB2' ' A' ' 12' ' ' ASN . 6.9 t70 -65.14 124.93 23.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.306 -1.114 . . . . 0.0 110.452 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.929 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.16 -36.09 28.77 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.261 -0.9 . . . . 0.0 110.388 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.481 ' HB2' ' OD1' ' A' ' 10' ' ' ASP . 3.9 m-20 -69.2 -46.83 66.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.162 -0.961 . . . . 0.0 110.682 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.534 ' CG2' HD11 ' A' ' 72' ' ' ILE . 54.9 m -57.69 -24.05 54.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.148 -0.97 . . . . 0.0 110.298 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.968 ' HA ' HD12 ' A' ' 17' ' ' LEU . 51.9 mt -69.06 -32.36 71.76 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.415 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -59.59 -38.24 80.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 110.373 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 5.8 t -70.08 -36.64 75.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.158 -0.964 . . . . 0.0 110.506 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.968 HD12 ' HA ' ' A' ' 14' ' ' LEU . 31.6 mt -58.6 -50.9 72.13 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.239 -0.913 . . . . 0.0 110.308 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.576 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 11.0 ttm180 -46.4 -27.21 1.0 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.147 -0.971 . . . . 0.0 110.548 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.456 ' CD1' ' C ' ' A' ' 19' ' ' TYR . 9.5 t80 -64.93 -42.08 94.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.141 -0.974 . . . . 0.0 110.612 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.55 ' O ' ' CD2' ' A' ' 24' ' ' HIS . 74.1 mtt180 -72.13 -22.4 61.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.086 -1.009 . . . . 0.0 110.447 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.576 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 12.8 m-30 -66.58 -9.85 39.52 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.131 -0.981 . . . . 0.0 110.275 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -63.59 -50.92 67.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.257 -0.902 . . . . 0.0 110.536 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -75.14 -14.75 60.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.121 -0.987 . . . . 0.0 110.313 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.593 ' CG ' HD12 ' A' ' 27' ' ' LEU . 7.1 m-70 -94.92 19.89 9.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.183 -0.948 . . . . 0.0 110.221 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.496 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 24.5 p -56.83 -24.76 53.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 0.0 110.052 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.463 HG22 ' H ' ' A' ' 26' ' ' THR . 3.5 t -97.08 3.48 51.75 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 110.161 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.593 HD12 ' CG ' ' A' ' 24' ' ' HIS . 23.9 mt -92.13 -32.49 15.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.507 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.496 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 50.8 p90 -117.6 167.53 11.24 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.039 -1.038 . . . . 0.0 109.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.8 m -100.26 -31.09 11.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.185 -0.947 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.93 117.03 2.56 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.104 -0.998 . . . . 0.0 110.792 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.498 ' O ' HG13 ' A' ' 31' ' ' VAL . 3.0 p -89.04 114.71 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.211 -0.931 . . . . 0.0 110.146 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.597 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 88.5 p -68.18 143.31 55.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.461 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 2.2 p -61.41 162.06 8.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.284 -0.885 . . . . 0.0 110.128 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.851 ' CG2' ' HB1' ' A' ' 47' ' ' ALA . 91.3 m -67.96 134.57 50.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.224 -0.922 . . . . 0.0 110.098 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.534 ' O ' ' N ' ' A' ' 48' ' ' ILE . 41.9 p-90 -146.52 -179.21 6.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.141 -0.975 . . . . 0.0 109.921 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.607 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 46.1 t60 -162.52 174.32 12.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.992 . . . . 0.0 110.417 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.607 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 89.0 m95 -78.43 105.39 9.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.87 . . . . 0.0 110.185 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 46.3 m . . . . . 0 N--CA 1.489 1.516 0 O-C-N 121.41 -0.806 . . . . 0.0 110.109 -179.927 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.851 ' HB1' ' CG2' ' A' ' 34' ' ' THR . . . . . . . . 0 N--CA 1.492 1.637 0 CA-C-O 121.378 0.609 . . . . 0.0 110.509 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.579 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.5 mt -142.93 134.3 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.364 -0.835 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.402 HG12 ' N ' ' A' ' 50' ' ' THR . 62.0 t -106.92 161.2 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.575 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 22.4 m -145.82 160.15 42.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.296 -0.877 . . . . 0.0 109.885 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.2 134.85 38.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.178 -0.951 . . . . 0.0 110.266 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.24 128.35 43.08 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 110.423 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.445 ' OH ' ' CD2' ' A' ' 62' ' ' PHE . 61.5 m-85 -118.42 151.01 38.59 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.308 -0.87 . . . . 0.0 110.228 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -103.72 -16.67 15.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.217 -0.927 . . . . 0.0 110.341 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.3 m -128.61 131.53 48.13 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 0.0 110.125 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -57.44 -50.04 74.31 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.237 -0.915 . . . . 0.0 110.347 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.65 -43.71 69.02 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.187 -0.945 . . . . 0.0 110.429 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -57.79 -44.91 86.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.313 -0.867 . . . . 0.0 110.589 -179.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.429 ' HD2' HG23 ' A' ' 5' ' ' VAL . 4.9 ttt-85 -58.79 -40.45 84.06 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.041 -1.037 . . . . 0.0 110.039 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -61.42 -36.18 79.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.478 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 61.9 mt-30 -65.64 -44.85 85.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.297 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.64 ' O ' HG22 ' A' ' 66' ' ' VAL . 4.2 t80 -55.75 -46.16 77.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.279 -0.888 . . . . 0.0 110.598 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.44 -23.0 62.31 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.927 . . . . 0.0 110.747 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 59.9 p -93.01 -19.87 21.15 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.074 -1.017 . . . . 0.0 110.619 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 27.9 mt-30 -95.83 -8.6 33.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.154 -0.966 . . . . 0.0 110.173 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.738 ' O ' HG23 ' A' ' 66' ' ' VAL . 16.9 m -111.82 108.57 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 0.0 110.047 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -65.61 107.79 1.84 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 110.243 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.404 ' HA ' HD13 ' A' ' 68' ' ' ILE . 16.2 mm -88.96 128.36 52.33 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.218 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 1.078 ' CG ' HD12 ' A' ' 72' ' ' ILE . 43.4 Cg_endo -58.83 -155.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.948 1.499 . . . . 0.0 110.366 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . 0.521 ' O ' ' HD3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -111.02 40.76 1.96 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -0.972 . . . . 0.0 110.554 -179.729 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.74 -15.64 0.12 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.266 -0.896 . . . . 0.0 111.663 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 1.078 HD12 ' CG ' ' A' ' 69' ' ' PRO . 19.1 mt -94.95 103.44 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 120.693 -1.255 . . . . 0.0 110.037 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . 0.429 HG22 ' N ' ' A' ' 74' ' ' VAL . 61.6 m -95.85 163.9 12.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.289 -0.882 . . . . 0.0 109.969 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.734 HG11 HG13 ' A' ' 5' ' ' VAL . 21.3 t -143.11 130.09 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.056 -1.028 . . . . 0.0 111.651 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 177.43 4.9 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.293 0.568 . . . . 0.0 110.089 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.406 ' O ' ' O ' ' B' ' 80' ' ' SER . 0.7 OUTLIER -111.84 152.97 27.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.176 -0.952 . . . . 0.0 110.252 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.865 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -158.87 168.7 35.04 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' B' ' 78' ' ' PHE . 70.9 m-85 -147.71 124.82 11.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.142 -1.211 . . . . 0.0 110.174 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.3 174.24 6.59 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.223 -0.923 . . . . 0.0 110.384 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.543 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -144.21 106.34 4.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.28 -0.888 . . . . 0.0 110.105 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.543 HG23 ' C ' ' A' ' 80' ' ' SER . 10.7 pt . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.266 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.185 0.517 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . 0.436 ' O ' HG23 ' B' ' 4' ' ' ILE . 24.4 p -125.74 108.59 25.65 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.178 -0.951 . . . . 0.0 110.323 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -49.3 150.04 8.33 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.06 1.558 . . . . 0.0 110.533 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.876 HD11 ' HA3' ' B' ' 77' ' ' GLY . 1.0 OUTLIER -143.88 176.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 0.0 110.391 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.722 HG13 HG11 ' B' ' 74' ' ' VAL . 77.6 t -145.89 120.91 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.245 -0.909 . . . . 0.0 110.1 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.574 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 0.0 OUTLIER -105.59 125.54 51.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.597 ' O ' HG23 ' B' ' 48' ' ' ILE . 3.1 mp -117.34 141.43 48.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.327 -0.858 . . . . 0.0 110.194 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.519 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 20.8 tptp -139.13 160.02 40.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.139 -0.976 . . . . 0.0 110.45 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.519 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 156.88 -156.6 27.31 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . 0.453 ' OD1' ' HB2' ' B' ' 12' ' ' ASN . 5.4 t70 -65.15 125.01 23.66 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.29 -1.124 . . . . 0.0 110.423 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.956 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.14 -36.8 31.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 110.47 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . 0.453 ' HB2' ' OD1' ' B' ' 10' ' ' ASP . 3.7 m-20 -68.35 -47.32 67.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.702 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.537 ' CG2' HD11 ' B' ' 72' ' ' ILE . 63.1 m -57.79 -23.04 50.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.151 -0.968 . . . . 0.0 110.247 -179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.956 HD12 ' HA ' ' B' ' 11' ' ' ALA . 53.9 mt -69.65 -32.11 70.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.289 -0.882 . . . . 0.0 110.285 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -59.72 -38.75 82.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.249 -0.907 . . . . 0.0 110.419 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.434 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 6.8 t -70.04 -36.64 75.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.927 . . . . 0.0 110.459 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.952 HD12 ' HA ' ' B' ' 14' ' ' LEU . 30.2 mt -58.59 -50.7 72.86 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.134 -0.978 . . . . 0.0 110.3 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.568 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 10.9 ttm180 -46.5 -27.13 1.01 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.401 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.463 ' CD1' ' C ' ' B' ' 19' ' ' TYR . 9.1 t80 -64.99 -42.35 94.59 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.188 -0.945 . . . . 0.0 110.694 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . 0.549 ' O ' ' CD2' ' B' ' 24' ' ' HIS . 74.8 mtt180 -71.58 -22.63 61.71 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.165 -0.959 . . . . 0.0 110.402 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.568 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 12.7 m-30 -66.44 -9.9 38.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.142 -0.974 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.67 -50.87 67.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.237 -0.914 . . . . 0.0 110.434 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -75.07 -14.66 60.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.201 -0.937 . . . . 0.0 110.235 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.585 ' CG ' HD12 ' B' ' 27' ' ' LEU . 7.8 m-70 -94.92 19.75 9.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.973 . . . . 0.0 110.186 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 25.4 p -57.08 -25.07 58.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.452 HG22 ' H ' ' B' ' 26' ' ' THR . 3.4 t -96.84 3.37 52.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.265 -0.897 . . . . 0.0 110.001 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.585 HD12 ' CG ' ' B' ' 24' ' ' HIS . 23.9 mt -92.03 -32.61 15.13 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.288 -0.883 . . . . 0.0 110.501 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.493 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 50.6 p90 -117.64 167.17 11.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.004 -1.06 . . . . 0.0 110.129 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.9 m -100.07 -31.06 11.61 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 110.665 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 116.88 2.55 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.006 -1.059 . . . . 0.0 110.744 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.519 ' O ' HG13 ' B' ' 31' ' ' VAL . 3.1 p -89.1 112.88 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.182 -0.949 . . . . 0.0 110.073 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.532 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 91.1 p -66.43 142.95 57.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.367 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 1.5 p -61.32 162.11 8.19 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.809 ' CG2' ' HB1' ' B' ' 47' ' ' ALA . 89.6 m -68.0 134.81 51.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 110.207 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.597 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 41.1 p-90 -146.36 -179.15 6.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.913 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.614 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 46.0 t60 -162.53 174.41 12.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.128 -0.982 . . . . 0.0 110.427 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.614 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 88.1 m95 -78.65 104.94 9.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.336 -0.853 . . . . 0.0 110.294 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 44.5 m . . . . . 0 N--CA 1.49 1.55 0 O-C-N 121.431 -0.793 . . . . 0.0 109.943 -179.914 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.809 ' HB1' ' CG2' ' B' ' 34' ' ' THR . . . . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 121.363 0.601 . . . . 0.0 110.645 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.597 HG23 ' O ' ' B' ' 7' ' ' LEU . 45.4 mt -142.59 134.85 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.289 -0.882 . . . . 0.0 110.025 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.64 161.22 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.157 -0.964 . . . . 0.0 110.522 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.574 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 23.6 m -145.88 160.32 41.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.805 . . . . 0.0 109.908 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.36 134.96 38.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.162 -0.962 . . . . 0.0 110.335 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 127.29 42.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.235 -0.915 . . . . 0.0 110.255 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' B' ' 62' ' ' PHE . 61.0 m-85 -117.11 150.81 38.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.349 -0.844 . . . . 0.0 109.982 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -103.49 -16.72 15.48 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 19.4 m -128.43 132.42 48.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.181 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -58.19 -49.89 75.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.885 . . . . 0.0 110.252 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.76 -43.52 69.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.342 -0.849 . . . . 0.0 110.527 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -57.85 -45.29 86.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.319 -0.863 . . . . 0.0 110.612 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.463 ' HD2' HG23 ' B' ' 5' ' ' VAL . 4.7 ttt-85 -58.83 -40.86 85.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.091 -1.005 . . . . 0.0 110.119 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -61.12 -35.79 77.99 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.862 . . . . 0.0 110.301 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.464 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 60.3 mt-30 -65.61 -45.21 84.0 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.243 -0.91 . . . . 0.0 110.391 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.66 ' O ' HG22 ' B' ' 66' ' ' VAL . 4.4 t80 -55.53 -46.2 77.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.314 -0.866 . . . . 0.0 110.703 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.57 -22.03 61.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.233 -0.917 . . . . 0.0 110.693 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 58.9 p -93.92 -19.82 20.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.247 -0.908 . . . . 0.0 110.574 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . 0.464 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 30.0 mt-30 -95.82 -9.58 31.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.21 -0.931 . . . . 0.0 110.066 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.73 HG23 ' O ' ' B' ' 66' ' ' VAL . 16.8 m -110.75 109.02 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.865 . . . . 0.0 110.155 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -66.31 107.96 2.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.347 -0.846 . . . . 0.0 110.266 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.437 ' O ' ' O ' ' B' ' 69' ' ' PRO . 17.1 mm -89.1 127.45 55.45 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.41 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 1.081 ' CG ' HD12 ' B' ' 72' ' ' ILE . 43.5 Cg_endo -57.46 -155.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 124.054 1.555 . . . . 0.0 110.442 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . 0.521 ' HD3' ' O ' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -112.15 40.84 2.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.025 -1.047 . . . . 0.0 110.458 -179.775 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.63 -15.7 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.295 -0.878 . . . . 0.0 111.616 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 1.081 HD12 ' CG ' ' B' ' 69' ' ' PRO . 20.7 mt -94.98 102.95 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 120.934 -1.104 . . . . 0.0 109.898 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . 0.425 HG22 ' N ' ' B' ' 74' ' ' VAL . 66.0 m -95.45 163.71 13.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.883 . . . . 0.0 110.083 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.722 HG11 HG13 ' B' ' 5' ' ' VAL . 21.5 t -142.88 130.64 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.05 -1.031 . . . . 0.0 111.615 -178.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . 0.429 ' HB3' HG22 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -101.97 178.7 4.54 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.144 179.62 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.7 OUTLIER -113.75 151.07 32.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 179.81 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.876 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -157.23 169.7 34.32 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' A' ' 78' ' ' PHE . 69.4 m-85 -147.85 126.57 12.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -1.153 . . . . 0.0 110.136 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.541 ' CE ' ' CE1' ' A' ' 6' ' ' HIS . 0.0 OUTLIER -100.57 172.59 7.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.093 -1.005 . . . . 0.0 110.297 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.54 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.1 OUTLIER -142.48 107.06 4.82 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.897 . . . . 0.0 109.875 179.86 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.54 HG23 ' C ' ' B' ' 80' ' ' SER . 10.5 pt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.284 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.5 ' HB2' ' CE2' ' A' ' 78' ' ' PHE . 23.9 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 53' ' ' TYR . 52.1 m -128.04 133.17 24.84 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.294 -0.879 . . . . 0.0 109.913 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.517 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -81.5 161.7 19.51 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.925 1.487 . . . . 0.0 110.319 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.609 HG22 ' CG2' ' A' ' 52' ' ' THR . 6.5 pt -144.05 163.63 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.093 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.8 t -145.75 129.84 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.2 OUTLIER -105.37 137.0 43.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.267 -0.895 . . . . 0.0 110.374 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.671 HD21 ' HB ' ' A' ' 49' ' ' VAL . 3.4 pp -125.38 142.78 51.31 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.343 -0.848 . . . . 0.0 109.826 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.831 ' O ' HD13 ' A' ' 72' ' ' ILE . 21.6 tptt -136.18 154.82 50.84 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.054 -1.028 . . . . 0.0 110.833 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 161.89 -178.74 37.63 Favored Glycine 0 N--CA 1.486 1.985 0 N-CA-C 108.455 -1.858 . . . . 0.0 108.455 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.56 150.47 48.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.976 -1.308 . . . . 0.0 111.07 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.849 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.83 -52.18 43.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.143 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -48.82 -45.55 40.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.11 -0.994 . . . . 0.0 110.16 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.2 m -58.03 -20.89 42.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.33 -0.856 . . . . 0.0 110.203 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.849 HD12 ' HA ' ' A' ' 11' ' ' ALA . 16.5 mt -83.93 -32.32 25.15 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.235 -0.915 . . . . 0.0 110.302 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -60.91 -37.04 80.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.075 -1.016 . . . . 0.0 110.488 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -47.77 59.27 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.268 -0.895 . . . . 0.0 111.384 -179.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.0 mt -58.44 -52.38 65.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.072 -1.017 . . . . 0.0 110.539 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 -45.66 -33.94 3.2 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -64.73 -13.13 53.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.233 -0.917 . . . . 0.0 110.163 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.22 -33.2 10.53 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.244 -0.91 . . . . 0.0 110.241 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.561 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 8.7 m-30 -66.59 -33.63 76.1 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.48 -44.83 93.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 110.383 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -75.03 -32.63 61.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.187 -0.946 . . . . 0.0 110.249 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.606 ' O ' ' N ' ' A' ' 26' ' ' THR . 28.6 m170 -95.78 34.65 1.48 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.322 -0.861 . . . . 0.0 110.34 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.601 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 13.2 p -59.6 43.53 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.435 -0.791 . . . . 0.0 112.011 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.606 ' N ' ' O ' ' A' ' 24' ' ' HIS . 75.3 p -144.72 33.29 1.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.768 -1.208 . . . . 0.0 109.663 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.405 ' HG ' ' C ' ' A' ' 26' ' ' THR . 78.6 mt -146.31 -5.79 0.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.183 -0.948 . . . . 0.0 111.448 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.601 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 10.5 p90 -126.13 162.38 25.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.686 -1.259 . . . . 0.0 108.912 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.495 ' HB ' ' O ' ' A' ' 52' ' ' THR . 6.6 m -101.81 -38.74 7.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.641 -1.287 . . . . 0.0 111.34 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.01 120.08 2.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.881 -1.137 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.652 ' O ' HG22 ' B' ' 38' ' ' THR . 3.2 p -88.97 105.65 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.281 -0.887 . . . . 0.0 109.893 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.608 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 54.7 p -64.35 152.87 40.14 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.528 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.46 155.56 21.49 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.278 -0.888 . . . . 0.0 110.109 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . 0.58 ' HA ' HG22 ' A' ' 49' ' ' VAL . 31.9 m -68.05 129.18 39.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.223 -0.923 . . . . 0.0 110.546 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.604 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 50.5 p-90 -147.13 179.92 7.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.207 -0.933 . . . . 0.0 110.125 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.539 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 36.2 t-80 -162.57 173.27 14.19 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.977 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.539 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 98.1 m95 -79.07 126.0 30.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.13 -0.981 . . . . 0.0 109.928 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.416 HG22 ' O ' ' B' ' 31' ' ' VAL . 11.4 t . . . . . 0 N--CA 1.491 1.586 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.766 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 1.603 0 CA-C-O 121.325 0.583 . . . . 0.0 110.189 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.628 HG23 ' O ' ' A' ' 7' ' ' LEU . 68.7 mt -142.8 155.99 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.406 -0.809 . . . . 0.0 109.854 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.671 ' HB ' HD21 ' A' ' 7' ' ' LEU . 87.2 t -136.24 129.79 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.144 -0.972 . . . . 0.0 110.524 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.469 ' OG1' ' NE2' ' A' ' 6' ' ' HIS . 86.5 m -93.94 150.06 20.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.071 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.55 HD12 HD23 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -135.05 121.18 20.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.103 -0.998 . . . . 0.0 110.055 179.993 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.609 ' CG2' HG22 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -99.0 144.26 28.36 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 110.408 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.517 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 26.4 m-85 -124.08 156.73 36.07 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 109.839 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -83.67 -6.03 59.34 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.149 -0.97 . . . . 0.0 110.682 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.1 m -163.98 156.4 17.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.092 -1.005 . . . . 0.0 110.408 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 62.9 mt-10 -68.62 -41.25 79.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.258 -0.901 . . . . 0.0 110.28 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.412 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 6.0 t90 -53.64 -52.75 58.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.179 -0.95 . . . . 0.0 109.982 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.46 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 48.1 tt0 -58.98 -32.86 70.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.384 -0.823 . . . . 0.0 110.253 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 3.6 ttm180 -59.02 -54.52 46.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.302 -0.874 . . . . 0.0 110.621 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -61.04 -25.87 67.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.193 -0.942 . . . . 0.0 110.32 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.46 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 68.4 mt-30 -65.63 -54.36 28.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.159 -0.963 . . . . 0.0 110.308 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.9 ' CE2' HG21 ' A' ' 66' ' ' VAL . 7.2 t80 -55.76 -46.75 77.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.343 -0.848 . . . . 0.0 110.456 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.4 mt -59.14 -20.64 55.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.281 -0.887 . . . . 0.0 110.343 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.44 -22.54 19.56 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.904 . . . . 0.0 110.289 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -96.41 -21.56 17.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.2 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.9 HG21 ' CE2' ' A' ' 62' ' ' PHE . 59.9 t -97.55 105.55 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.47 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . 0.422 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.7 OUTLIER -58.26 103.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.899 179.664 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.581 HG23 ' CG2' ' A' ' 72' ' ' ILE . 40.6 mt -88.9 99.51 1.57 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 110.094 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HG2' HG12 ' A' ' 72' ' ' ILE . 46.8 Cg_endo -45.13 159.41 0.15 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.069 1.563 . . . . 0.0 110.36 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -63.82 -13.68 46.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.5 p -84.62 -21.11 30.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.268 -0.895 . . . . 0.0 110.195 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.831 HD13 ' O ' ' A' ' 8' ' ' LYS . 6.8 mm -94.24 113.47 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.0 110.183 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.5 m -94.35 145.06 25.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.252 -0.905 . . . . 0.0 110.174 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.51 171.8 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.204 -0.935 . . . . 0.0 110.921 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.596 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.6 OUTLIER -142.68 154.65 44.52 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.576 -0.703 . . . . 0.0 110.496 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 60.4 p -131.77 134.89 46.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.174 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.34 -170.7 34.2 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' B' ' 78' ' ' PHE . 0.0 OUTLIER -147.71 143.91 27.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.362 -1.081 . . . . 0.0 110.033 -179.934 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.2 mmm -135.89 155.42 50.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.779 -1.201 . . . . 0.0 110.649 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.81 108.56 5.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 0.0 110.065 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.3 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.216 -179.972 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.514 ' HB2' ' CE2' ' B' ' 78' ' ' PHE . 22.5 mtp . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.205 0.526 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . 0.514 HG23 ' O ' ' B' ' 53' ' ' TYR . 58.8 m -127.31 133.84 25.51 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.382 -0.824 . . . . 0.0 110.154 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.51 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -82.19 161.2 17.82 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.918 1.483 . . . . 0.0 110.287 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.617 HG22 ' CG2' ' B' ' 52' ' ' THR . 6.4 pt -143.99 163.36 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.242 -0.911 . . . . 0.0 110.096 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -145.78 130.89 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.237 -0.915 . . . . 0.0 110.267 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.588 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.2 OUTLIER -106.1 138.91 41.45 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.244 -0.91 . . . . 0.0 110.349 -179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.654 HD21 ' HB ' ' B' ' 49' ' ' VAL . 3.5 pp -127.96 142.9 51.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.195 -0.941 . . . . 0.0 110.299 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.859 ' O ' HD13 ' B' ' 72' ' ' ILE . 24.1 tptt -140.21 163.17 33.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.118 -0.989 . . . . 0.0 110.526 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.509 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 166.16 -79.7 0.12 Allowed Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -173.28 150.7 1.92 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.252 -1.146 . . . . 0.0 109.509 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.653 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.39 -57.3 7.17 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 110.645 -179.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -50.65 -48.51 58.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.408 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 69.8 m -58.19 -21.99 49.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.171 -0.956 . . . . 0.0 110.484 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' B' ' 11' ' ' ALA . 16.3 mt -83.34 -32.83 26.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -0.977 . . . . 0.0 110.603 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 ttmt -60.81 -36.98 80.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.016 -1.053 . . . . 0.0 110.635 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -47.5 61.98 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.232 -0.917 . . . . 0.0 111.181 -179.191 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.3 mt -58.54 -52.7 64.53 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.104 -0.998 . . . . 0.0 110.664 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -45.28 -33.69 2.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.232 -0.917 . . . . 0.0 110.135 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -64.82 -13.64 56.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.269 -0.895 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.48 -33.4 10.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.169 -0.957 . . . . 0.0 110.172 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.1 m-30 -66.49 -33.91 76.74 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.23 -0.919 . . . . 0.0 110.355 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.42 -44.7 93.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.343 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 mmtm -74.97 -32.93 61.81 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.184 -0.947 . . . . 0.0 110.26 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.602 ' O ' ' N ' ' B' ' 26' ' ' THR . 28.8 m170 -95.48 35.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.281 -0.887 . . . . 0.0 110.238 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.604 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.3 p -59.78 43.07 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.467 -0.771 . . . . 0.0 112.139 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.602 ' N ' ' O ' ' B' ' 24' ' ' HIS . 77.8 p -144.69 33.84 1.15 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.729 -1.232 . . . . 0.0 109.846 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.423 ' HG ' ' C ' ' B' ' 26' ' ' THR . 81.5 mt -146.5 -6.04 0.55 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.237 -0.914 . . . . 0.0 111.375 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 10.9 p90 -125.42 162.61 24.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.701 -1.249 . . . . 0.0 108.779 178.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' B' ' 52' ' ' THR . 6.9 m -101.77 -39.01 7.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.642 -1.286 . . . . 0.0 111.187 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.97 120.18 2.97 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.059 -1.025 . . . . 0.0 111.185 -179.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.565 ' O ' HG13 ' B' ' 31' ' ' VAL . 3.3 p -89.09 105.26 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.006 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.604 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.3 p -64.39 153.05 39.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.252 -0.905 . . . . 0.0 110.557 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.22 155.98 19.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.272 -0.892 . . . . 0.0 110.42 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . 0.587 ' HA ' HG22 ' B' ' 49' ' ' VAL . 26.8 m -68.17 128.48 36.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.382 -0.824 . . . . 0.0 110.343 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.608 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 49.7 p-90 -146.94 179.51 7.54 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.536 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 36.4 t-80 -162.28 173.3 14.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.081 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.536 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 98.0 m95 -79.18 125.19 29.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 0.0 110.009 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . 0.652 HG22 ' O ' ' A' ' 31' ' ' VAL . 11.3 t . . . . . 0 N--CA 1.492 1.644 0 O-C-N 121.234 -0.916 . . . . 0.0 110.157 -179.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.654 0 CA-C-O 121.255 0.55 . . . . 0.0 110.327 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.589 HG23 ' O ' ' B' ' 7' ' ' LEU . 62.8 mt -143.1 156.13 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.32 -0.862 . . . . 0.0 109.987 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . 0.654 ' HB ' HD21 ' B' ' 7' ' ' LEU . 76.2 t -136.25 129.84 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 110.537 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.504 ' OG1' ' NE2' ' B' ' 6' ' ' HIS . 87.1 m -94.01 149.78 20.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.367 -0.833 . . . . 0.0 109.873 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.542 HD12 HD23 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -134.69 121.56 20.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.043 -1.036 . . . . 0.0 110.052 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.617 ' CG2' HG22 ' B' ' 4' ' ' ILE . 0.0 OUTLIER -99.22 144.57 28.2 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.313 -0.867 . . . . 0.0 110.607 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.514 ' O ' HG23 ' B' ' 2' ' ' THR . 26.0 m-85 -124.62 157.09 36.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.268 -0.895 . . . . 0.0 109.893 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -84.0 -6.99 59.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.264 -0.898 . . . . 0.0 110.664 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.57 157.81 22.57 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.101 -0.999 . . . . 0.0 110.354 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 57.9 mt-10 -70.16 -41.11 74.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.234 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . 0.409 ' O ' ' HG3' ' B' ' 61' ' ' GLN . 6.0 t90 -53.56 -52.55 59.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.093 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 46.5 tt0 -59.28 -32.55 70.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.855 . . . . 0.0 110.233 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 3.7 ttm180 -59.11 -54.38 47.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.228 -0.92 . . . . 0.0 110.448 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.15 -26.07 67.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.217 -0.927 . . . . 0.0 110.324 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 68.0 mt-30 -65.55 -54.28 30.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.207 -0.933 . . . . 0.0 110.229 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.893 ' CZ ' HG21 ' B' ' 66' ' ' VAL . 7.1 t80 -55.91 -46.69 78.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.318 -0.864 . . . . 0.0 110.518 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.4 mt -59.31 -20.71 56.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.55 -22.3 19.6 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.228 -0.92 . . . . 0.0 110.368 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -96.33 -22.0 17.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.22 -0.925 . . . . 0.0 110.023 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.893 HG21 ' CZ ' ' B' ' 62' ' ' PHE . 60.7 t -97.22 107.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.341 -0.849 . . . . 0.0 110.341 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.28 103.22 0.22 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -0.885 . . . . 0.0 109.855 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.613 HG23 ' CG2' ' B' ' 72' ' ' ILE . 40.1 mt -88.68 98.68 1.17 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.244 -0.91 . . . . 0.0 110.264 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.477 ' HG2' HG12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -43.99 159.45 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.998 1.525 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 20.9 mtmt -63.73 -13.84 47.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.22 -0.925 . . . . 0.0 110.263 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.3 p -84.64 -20.94 30.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 0.0 110.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.859 HD13 ' O ' ' B' ' 8' ' ' LYS . 6.8 mm -93.75 113.22 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 0.0 110.108 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.1 m -94.3 144.96 25.09 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.305 -0.872 . . . . 0.0 110.091 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.54 171.57 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 110.973 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . 0.588 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -142.93 154.0 43.63 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.613 -0.68 . . . . 0.0 110.516 179.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 60.9 p -131.43 135.72 47.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.293 -0.88 . . . . 0.0 110.146 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.47 -170.89 34.54 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' A' ' 78' ' ' PHE . 0.0 OUTLIER -147.69 143.64 27.77 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.253 -1.145 . . . . 0.0 109.964 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.4 mmm -135.7 155.64 50.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.951 -1.093 . . . . 0.0 110.742 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -142.33 109.27 5.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.383 -0.823 . . . . 0.0 109.982 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.216 -179.907 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' A' ' 78' ' ' PHE . 3.5 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.297 0.57 . . . . 0.0 110.307 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.39 108.67 61.95 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.275 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.511 ' O ' ' HA ' ' A' ' 52' ' ' THR . 51.9 Cg_endo -68.68 143.3 55.84 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.019 1.536 . . . . 0.0 110.047 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.42 HG23 ' C ' ' A' ' 3' ' ' PRO . 3.0 pt -144.69 164.75 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.142 -0.974 . . . . 0.0 110.778 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.404 ' CG2' ' HB2' ' A' ' 51' ' ' LEU . 17.1 m -144.54 147.05 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.724 . . . . 0.0 109.497 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -105.71 127.91 53.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.047 -1.033 . . . . 0.0 110.687 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.948 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -116.78 136.0 53.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.536 ' HG3' ' CG1' ' A' ' 48' ' ' ILE . 13.4 ttmt -140.12 164.47 29.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.221 -0.924 . . . . 0.0 110.26 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 152.49 -174.95 31.29 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.89 136.9 57.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.25 -1.147 . . . . 0.0 110.088 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . 0.778 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.97 -23.31 1.94 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 110.136 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -68.95 -59.84 2.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.22 -0.925 . . . . 0.0 110.304 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.438 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -57.96 -21.67 45.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.324 -0.86 . . . . 0.0 110.21 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.778 HD12 ' HA ' ' A' ' 11' ' ' ALA . 17.9 mt -66.8 -45.57 77.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.303 -0.873 . . . . 0.0 110.443 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -59.93 -31.26 69.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.186 -0.947 . . . . 0.0 110.373 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.513 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.1 t -69.94 -41.75 74.15 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.237 -0.914 . . . . 0.0 110.545 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 13' ' ' THR . 82.3 mt -58.96 -52.48 65.58 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.118 -0.989 . . . . 0.0 110.435 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 24.3 ttt-85 -48.89 -24.35 1.44 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.299 -0.875 . . . . 0.0 110.525 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 9.8 t80 -64.54 -40.67 96.03 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.106 -0.996 . . . . 0.0 110.282 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 mtm-85 -76.17 -15.53 60.04 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.173 -0.955 . . . . 0.0 110.029 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.586 ' CE2' HD21 ' A' ' 51' ' ' LEU . 3.7 m-30 -66.33 -30.9 71.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.251 -0.905 . . . . 0.0 109.836 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -63.31 -33.96 76.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -0.915 . . . . 0.0 109.883 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -74.89 -48.91 22.33 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.85 . . . . 0.0 109.732 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.573 ' HB3' HD22 ' A' ' 27' ' ' LEU . 54.4 m-70 -95.27 28.51 2.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.333 -0.855 . . . . 0.0 109.761 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.714 ' SG ' HG23 ' A' ' 26' ' ' THR . 22.6 p -56.75 -22.02 32.53 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 110.027 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.714 HG23 ' SG ' ' A' ' 25' ' ' CYS . 23.0 p -97.22 10.94 38.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -0.853 . . . . 0.0 109.949 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.573 HD22 ' HB3' ' A' ' 24' ' ' HIS . 0.7 OUTLIER -92.1 -43.37 9.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.0 110.175 179.903 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.632 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 19.8 p90 -96.41 175.72 6.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.1 -1.0 . . . . 0.0 109.965 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.441 ' OG1' ' HB2' ' A' ' 54' ' ' ASP . 88.7 m -101.27 -34.44 9.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.081 -1.012 . . . . 0.0 111.349 -179.285 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.65 118.88 2.52 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.953 -1.092 . . . . 0.0 110.969 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.506 HG13 ' CE1' ' A' ' 28' ' ' TYR . 7.4 m -89.39 100.0 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.973 -1.08 . . . . 0.0 109.623 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.584 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 58.0 p -47.55 144.34 3.17 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.302 -0.874 . . . . 0.0 110.771 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.1 p -61.86 164.92 5.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.228 -0.92 . . . . 0.0 109.948 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.9 m -68.03 120.5 14.36 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.117 -0.99 . . . . 0.0 110.142 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.516 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 32.7 p-90 -146.52 -174.02 4.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 109.64 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.559 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 28.2 t-80 -162.78 171.51 16.64 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.861 -1.149 . . . . 0.0 111.117 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.559 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 22.0 m95 -78.74 93.76 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.472 -0.767 . . . . 0.0 110.151 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.469 ' O ' ' O ' ' B' ' 31' ' ' VAL . 4.0 t . . . . . 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.679 0 CA-C-O 121.266 0.555 . . . . 0.0 110.51 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.948 HG23 ' O ' ' A' ' 7' ' ' LEU . 63.3 mt -141.89 149.65 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.37 -0.831 . . . . 0.0 110.153 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 40.4 t -120.2 121.32 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.275 -0.891 . . . . 0.0 110.814 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.483 ' HB ' ' OG ' ' A' ' 32' ' ' SER . 33.2 m -93.73 148.95 21.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.329 -0.857 . . . . 0.0 109.131 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.586 HD21 ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -135.04 122.61 22.05 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.921 -1.112 . . . . 0.0 110.789 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 3' ' ' PRO . 26.1 m -98.12 144.26 27.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.547 -0.721 . . . . 0.0 109.416 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.504 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 55.2 m-85 -120.77 155.86 33.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.037 -1.039 . . . . 0.0 110.659 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . 0.441 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 2.9 t70 -78.16 -9.39 59.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 110.832 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 56' ' ' GLU . 3.0 m -163.3 127.67 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.053 -1.029 . . . . 0.0 110.341 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -45.28 -41.76 8.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.218 -0.926 . . . . 0.0 109.834 179.666 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . 0.456 ' CE3' ' HA ' ' A' ' 57' ' ' TRP . 6.1 t-105 -54.05 -51.03 65.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.367 -0.833 . . . . 0.0 110.077 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.428 ' HA ' ' NE2' ' A' ' 61' ' ' GLN . 4.3 tp60 -58.35 -37.78 75.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.266 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.4 ttp85 -59.14 -44.31 92.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.194 -0.941 . . . . 0.0 110.674 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -36.85 80.9 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.158 -0.964 . . . . 0.0 110.16 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.428 ' NE2' ' HA ' ' A' ' 58' ' ' GLN . 37.8 mt-30 -65.68 -41.19 92.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.161 -0.962 . . . . 0.0 110.388 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.753 ' CZ ' HG11 ' A' ' 66' ' ' VAL . 23.5 t80 -55.96 -48.14 76.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.335 -0.853 . . . . 0.0 110.13 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 1.053 HD21 HG11 ' A' ' 74' ' ' VAL . 15.4 mt -59.09 -14.88 11.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.33 -0.857 . . . . 0.0 110.448 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.7 p -99.98 -21.46 15.64 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.7 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.539 HE22 HD21 ' A' ' 27' ' ' LEU . 31.6 mt-30 -94.13 -29.03 15.36 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.111 -0.993 . . . . 0.0 110.704 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.753 HG11 ' CZ ' ' A' ' 62' ' ' PHE . 5.5 m -89.79 172.89 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.126 -0.984 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.67 91.73 3.69 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.887 . . . . 0.0 109.459 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.821 HG21 HG21 ' A' ' 74' ' ' VAL . 29.7 mm -88.64 107.48 17.31 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.266 -0.896 . . . . 0.0 110.452 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.966 ' HG2' HD12 ' A' ' 72' ' ' ILE . 43.9 Cg_endo -54.66 -169.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.002 1.528 . . . . 0.0 110.231 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.65 -6.77 24.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.265 -0.897 . . . . 0.0 110.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -84.71 -23.81 29.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.351 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.966 HD12 ' HG2' ' A' ' 69' ' ' PRO . 3.5 mt -94.2 135.42 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.439 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.1 m -95.14 119.84 34.33 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.158 -0.964 . . . . 0.0 110.328 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 1.053 HG11 HD21 ' A' ' 63' ' ' LEU . 88.0 t -102.15 97.72 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.86 . . . . 0.0 109.562 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 59.0 m -102.53 172.12 7.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.568 -1.333 . . . . 0.0 110.698 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.3 p -111.96 177.28 4.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.333 -0.855 . . . . 0.0 109.747 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . 0.449 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -179.25 179.06 48.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.479 ' O ' ' O ' ' B' ' 78' ' ' PHE . 25.7 m-85 -147.75 136.87 22.23 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -1.1 . . . . 0.0 110.124 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.5 mtp -119.94 172.61 7.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.116 -0.99 . . . . 0.0 110.408 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.19 100.96 7.49 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.294 -0.879 . . . . 0.0 109.725 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.404 -179.472 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.483 ' HE2' ' HB3' ' B' ' 78' ' ' PHE . 3.2 mtp . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.175 0.512 . . . . 0.0 110.322 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . 0.411 ' O ' HG23 ' B' ' 4' ' ' ILE . 0.7 OUTLIER -105.98 108.27 61.3 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.35 -0.844 . . . . 0.0 110.366 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.507 ' O ' ' HA ' ' B' ' 52' ' ' THR . 50.7 Cg_endo -67.87 143.26 60.26 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.917 1.483 . . . . 0.0 109.9 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.416 HG23 ' C ' ' B' ' 3' ' ' PRO . 2.8 pt -144.59 164.59 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.076 -1.015 . . . . 0.0 110.649 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.41 ' CG2' ' HB2' ' B' ' 51' ' ' LEU . 16.8 m -144.4 147.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.524 -0.735 . . . . 0.0 109.504 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -105.84 128.2 53.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.995 -1.066 . . . . 0.0 110.53 -179.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.926 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.2 OUTLIER -117.24 135.59 53.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.366 -0.834 . . . . 0.0 109.954 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.519 ' HG3' ' CG1' ' B' ' 48' ' ' ILE . 14.4 ttmt -139.78 164.35 30.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.211 -0.931 . . . . 0.0 110.11 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 152.66 -175.7 31.14 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.79 136.39 56.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.322 -1.105 . . . . 0.0 110.127 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . 0.783 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.15 -21.75 1.43 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.341 -0.849 . . . . 0.0 110.456 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -70.44 -58.99 3.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.203 -0.936 . . . . 0.0 110.024 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.425 ' O ' ' HG ' ' B' ' 17' ' ' LEU . 0.0 OUTLIER -58.1 -22.27 49.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.352 -0.843 . . . . 0.0 110.238 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.783 HD12 ' HA ' ' B' ' 11' ' ' ALA . 18.8 mt -66.75 -45.49 78.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.568 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.79 -31.13 69.4 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.153 -0.967 . . . . 0.0 110.325 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.513 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.1 t -70.28 -41.74 73.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.399 -0.813 . . . . 0.0 110.682 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' B' ' 13' ' ' THR . 83.2 mt -58.88 -52.69 64.65 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.018 -1.051 . . . . 0.0 110.333 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . 0.511 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 23.0 ttt-85 -48.68 -24.16 1.28 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 9.8 t80 -64.68 -40.62 95.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.025 -1.047 . . . . 0.0 110.316 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 69.9 mtm-85 -76.28 -14.82 60.1 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.226 -0.921 . . . . 0.0 110.038 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.601 ' CE2' HD21 ' B' ' 51' ' ' LEU . 3.7 m-30 -66.57 -31.09 71.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.24 -0.913 . . . . 0.0 109.85 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -63.38 -33.89 76.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.373 -0.829 . . . . 0.0 110.169 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -74.85 -49.06 21.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.677 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.577 ' HB3' HD22 ' B' ' 27' ' ' LEU . 47.0 m-70 -94.9 28.79 2.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.378 -0.826 . . . . 0.0 109.748 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.731 ' SG ' HG23 ' B' ' 26' ' ' THR . 21.2 p -57.07 -21.8 34.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.759 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.731 HG23 ' SG ' ' B' ' 25' ' ' CYS . 23.6 p -97.27 10.78 38.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 110.073 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.577 HD22 ' HB3' ' B' ' 24' ' ' HIS . 0.7 OUTLIER -92.16 -44.09 8.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.244 -0.91 . . . . 0.0 110.377 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.636 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 20.8 p90 -95.82 175.44 6.51 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.095 -1.003 . . . . 0.0 109.837 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.436 ' OG1' ' HB2' ' B' ' 54' ' ' ASP . 80.7 m -100.95 -33.69 10.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.108 -0.995 . . . . 0.0 111.429 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.75 118.82 2.48 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.049 -1.032 . . . . 0.0 110.972 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.533 HG13 ' CE1' ' B' ' 28' ' ' TYR . 8.1 m -89.43 99.84 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.649 179.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.516 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.2 p -47.24 143.18 3.43 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.317 -0.865 . . . . 0.0 110.776 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 14.1 p -61.62 164.48 5.94 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.907 179.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 65.8 m -68.04 121.02 15.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.114 -0.991 . . . . 0.0 110.345 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.584 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 31.2 p-90 -146.74 -173.43 4.21 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.341 -0.85 . . . . 0.0 109.539 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.549 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 28.9 t-80 -162.89 171.25 16.91 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.852 -1.155 . . . . 0.0 110.917 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.549 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 26.9 m95 -78.79 93.63 5.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.504 -0.748 . . . . 0.0 110.045 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.93 . . . . 0.0 110.438 179.955 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.532 0 CA-C-O 121.35 0.595 . . . . 0.0 110.247 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.926 HG23 ' O ' ' B' ' 7' ' ' LEU . 56.0 mt -141.87 150.29 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.171 -0.955 . . . . 0.0 110.098 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 41.3 t -121.11 121.17 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.233 -0.917 . . . . 0.0 110.731 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.471 ' HB ' ' OG ' ' B' ' 32' ' ' SER . 40.7 m -93.89 148.85 21.75 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.292 -0.88 . . . . 0.0 109.17 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . 0.601 HD21 ' CE2' ' B' ' 21' ' ' PHE . 0.4 OUTLIER -134.93 123.17 22.98 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.942 -1.099 . . . . 0.0 111.048 -179.417 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' B' ' 3' ' ' PRO . 24.1 m -98.19 143.81 28.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.515 -0.741 . . . . 0.0 109.61 179.042 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.505 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -120.52 155.31 33.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.066 -1.021 . . . . 0.0 110.552 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . 0.436 ' HB2' ' OG1' ' B' ' 29' ' ' THR . 3.0 t70 -77.69 -9.14 58.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.301 -0.874 . . . . 0.0 110.761 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.2 m -163.28 128.06 3.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.128 -0.983 . . . . 0.0 110.493 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -41.54 10.58 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.345 -0.847 . . . . 0.0 109.794 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . 0.447 ' HA ' ' CE3' ' B' ' 57' ' ' TRP . 6.0 t-105 -54.26 -51.22 65.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.318 -0.864 . . . . 0.0 110.027 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.44 ' CA ' ' OE1' ' B' ' 58' ' ' GLN . 4.1 tp60 -58.21 -37.25 74.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.16 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 40.0 ttp85 -59.32 -44.84 92.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.091 -1.006 . . . . 0.0 110.609 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -36.87 80.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.157 -0.964 . . . . 0.0 110.286 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.408 ' NE2' ' HA ' ' B' ' 58' ' ' GLN . 38.4 mt-30 -65.74 -41.08 92.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.292 -0.88 . . . . 0.0 110.29 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.786 ' CZ ' HG11 ' B' ' 66' ' ' VAL . 21.5 t80 -56.11 -48.28 76.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 0.0 110.223 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 1.057 HD21 HG11 ' B' ' 74' ' ' VAL . 15.0 mt -59.04 -14.2 8.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.357 -0.839 . . . . 0.0 110.277 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 17.8 p -100.54 -21.91 15.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.249 -0.907 . . . . 0.0 110.842 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . 0.542 HE22 HD21 ' B' ' 27' ' ' LEU . 30.3 mt-30 -94.09 -28.67 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.026 -1.046 . . . . 0.0 110.596 -178.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.786 HG11 ' CZ ' ' B' ' 62' ' ' PHE . 5.5 m -89.57 173.13 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.033 -1.042 . . . . 0.0 110.028 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.14 92.63 3.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.219 -0.926 . . . . 0.0 109.28 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.803 HG21 HG21 ' B' ' 74' ' ' VAL . 30.2 mm -88.99 107.23 16.39 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.366 -0.834 . . . . 0.0 110.438 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.96 ' HG2' HD12 ' B' ' 72' ' ' ILE . 44.8 Cg_endo -54.18 -168.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 124.034 1.544 . . . . 0.0 110.145 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.17 -6.52 24.17 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.138 -0.976 . . . . 0.0 110.411 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 47.8 p -84.84 -23.54 29.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.268 -0.895 . . . . 0.0 110.382 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.96 HD12 ' HG2' ' B' ' 69' ' ' PRO . 3.5 mt -94.15 135.23 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.258 -0.901 . . . . 0.0 110.416 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 39.7 m -95.22 119.87 34.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.174 -0.954 . . . . 0.0 110.217 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 1.057 HG11 HD21 ' B' ' 63' ' ' LEU . 88.6 t -101.81 97.69 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.171 -0.956 . . . . 0.0 109.42 177.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 58.2 m -102.47 172.2 7.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.476 -1.39 . . . . 0.0 110.628 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 72.8 p -112.53 176.34 5.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.401 -0.812 . . . . 0.0 109.823 179.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . 0.434 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -178.45 179.44 48.64 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.483 ' HB3' ' HE2' ' B' ' 1' ' ' MET . 26.7 m-85 -147.57 137.35 22.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -1.149 . . . . 0.0 110.194 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.6 mtp -120.11 172.64 7.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.129 -0.982 . . . . 0.0 110.338 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.78 100.97 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.305 -0.872 . . . . 0.0 109.73 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.191 -179.542 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . 0.441 ' HE2' ' CD2' ' A' ' 78' ' ' PHE . 69.1 mtp . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.188 0.518 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.5 p -143.97 144.99 28.54 Favored Pre-proline 0 N--CA 1.491 1.577 0 O-C-N 121.253 -0.905 . . . . 0.0 110.272 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.489 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 51.7 Cg_endo -94.16 155.93 2.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.047 1.551 . . . . 0.0 110.062 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . 0.525 HD13 ' HG3' ' A' ' 79' ' ' MET . 11.4 pt -144.32 166.55 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.136 -0.977 . . . . 0.0 110.563 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.684 HG13 HG21 ' A' ' 74' ' ' VAL . 24.4 t -145.72 124.14 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.378 -0.827 . . . . 0.0 110.017 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.501 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.2 OUTLIER -105.69 110.57 22.92 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 110.274 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.956 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.7 tp -112.97 150.59 31.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.201 -0.937 . . . . 0.0 110.258 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.747 ' O ' HG23 ' A' ' 72' ' ' ILE . 8.5 ttpp -142.33 170.43 15.72 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.51 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.473 ' O ' HD11 ' A' ' 14' ' ' LEU . . . 151.24 -179.87 27.54 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -65.04 137.12 57.5 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.276 -1.132 . . . . 0.0 110.217 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.32 -31.44 14.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.31 -0.869 . . . . 0.0 110.629 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -71.14 -55.1 8.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.224 -0.922 . . . . 0.0 110.765 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.1 m -57.85 -20.46 36.56 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.189 -0.945 . . . . 0.0 110.398 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . 0.473 HD11 ' O ' ' A' ' 9' ' ' GLY . 20.9 mt -90.34 -25.05 20.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.309 -0.87 . . . . 0.0 110.083 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.4 mmtp -58.88 -42.62 89.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.345 -0.847 . . . . 0.0 110.294 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 19.0 t -69.8 -34.5 73.8 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.425 -0.797 . . . . 0.0 110.435 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 19' ' ' TYR . 5.3 mp -58.85 -53.59 56.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.35 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -44.87 -22.97 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.8 -179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.455 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 85.7 t80 -64.57 -42.91 95.33 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.101 -0.999 . . . . 0.0 109.877 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -62.6 -27.44 69.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.864 . . . . 0.0 109.969 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.526 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.6 -16.86 64.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.375 -0.828 . . . . 0.0 110.264 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -63.44 -56.11 18.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 109.804 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.457 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.27 -24.76 57.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.399 -0.813 . . . . 0.0 109.834 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.64 ' CA ' HD13 ' A' ' 27' ' ' LEU . 19.5 m170 -94.97 33.21 1.53 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.397 -0.815 . . . . 0.0 110.015 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 23.0 p -57.28 -23.79 50.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.349 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 26' ' ' THR . 2.7 t -97.28 13.52 29.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.194 -0.941 . . . . 0.0 110.687 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' CA ' ' A' ' 24' ' ' HIS . 3.3 mp -92.31 -26.54 18.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -0.983 . . . . 0.0 110.32 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.499 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 34.8 p90 -118.39 167.89 11.14 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -0.988 . . . . 0.0 110.034 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.494 ' N ' ' O ' ' A' ' 52' ' ' THR . 3.6 m -100.01 -34.24 10.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.127 -0.983 . . . . 0.0 110.457 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.569 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.62 117.06 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.926 . . . . 0.0 110.636 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.641 HG13 ' O ' ' B' ' 38' ' ' THR . 14.8 p -90.21 129.74 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.113 -0.992 . . . . 0.0 109.919 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.683 ' O ' HG13 ' A' ' 49' ' ' VAL . 2.0 t -87.4 148.1 25.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.235 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 p -61.18 167.31 3.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.21 -0.931 . . . . 0.0 110.45 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.02 121.07 15.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.281 -0.887 . . . . 0.0 110.538 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.457 ' O ' ' N ' ' A' ' 48' ' ' ILE . 36.8 p-90 -146.93 175.47 10.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.247 -0.908 . . . . 0.0 109.847 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 47' ' ' ALA . 15.2 p-80 -162.57 173.39 14.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.07 -1.019 . . . . 0.0 110.702 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.403 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 92.2 m95 -79.66 125.35 29.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.531 -0.73 . . . . 0.0 110.106 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . 0.515 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.5 t . . . . . 0 N--CA 1.491 1.575 0 O-C-N 121.076 -1.015 . . . . 0.0 110.269 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.7 0 CA-C-O 121.373 0.606 . . . . 0.0 110.679 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.956 HG23 ' O ' ' A' ' 7' ' ' LEU . 46.3 mt -141.98 131.42 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.187 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . 0.683 HG13 ' O ' ' A' ' 32' ' ' SER . 4.3 t -118.34 125.89 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.243 -0.911 . . . . 0.0 110.189 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.479 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 88.0 m -93.82 157.43 16.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.221 -0.924 . . . . 0.0 110.094 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.6 mt -134.84 128.21 32.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.179 -0.951 . . . . 0.0 110.07 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.569 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 28.4 p -97.12 131.6 43.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.503 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 48.6 m-85 -112.52 150.21 31.6 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.185 -0.947 . . . . 0.0 110.218 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -74.96 -7.65 54.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.221 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.8 p -170.74 157.94 5.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.27 -0.894 . . . . 0.0 110.197 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.54 -37.64 88.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.325 -0.859 . . . . 0.0 110.354 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -54.03 -53.59 50.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.155 -0.965 . . . . 0.0 110.324 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -58.22 -35.46 71.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.299 -0.875 . . . . 0.0 110.44 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . 0.808 ' NH2' HG23 ' A' ' 76' ' ' THR . 22.4 ttt180 -58.91 -42.55 89.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.047 -1.033 . . . . 0.0 109.963 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -34.8 76.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -65.62 -45.5 82.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.185 -0.947 . . . . 0.0 110.466 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.678 ' O ' HG13 ' A' ' 66' ' ' VAL . 3.0 t80 -55.96 -49.47 73.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.279 -0.888 . . . . 0.0 110.826 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.572 ' HA ' HG22 ' A' ' 66' ' ' VAL . 97.6 mt -59.28 -46.06 89.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.266 -0.896 . . . . 0.0 110.765 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.1 -20.59 66.54 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.129 -0.982 . . . . 0.0 110.417 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -95.81 -17.39 21.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.91 . . . . 0.0 110.42 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.727 ' O ' HG23 ' A' ' 66' ' ' VAL . 10.9 m -108.66 113.44 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -0.939 . . . . 0.0 110.409 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 115.62 9.9 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 110.064 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.639 HD11 HD11 ' A' ' 7' ' ' LEU . 4.2 tp -88.31 142.62 31.67 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.194 -0.941 . . . . 0.0 110.207 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.601 ' CG ' HD12 ' A' ' 72' ' ' ILE . 47.8 Cg_endo -94.72 162.4 1.81 Allowed 'Trans proline' 0 C--N 1.305 -1.762 0 O-C-N 124.034 1.544 . . . . 0.0 110.464 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -65.35 -16.76 63.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.227 -0.921 . . . . 0.0 110.347 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.3 m -84.68 -31.42 24.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 110.576 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.747 HG23 ' O ' ' A' ' 8' ' ' LYS . 75.6 mt -93.51 148.94 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.096 -1.003 . . . . 0.0 110.641 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 87.7 m -145.52 154.15 41.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.399 -0.813 . . . . 0.0 109.994 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.691 ' HB ' HD12 ' A' ' 7' ' ' LEU . 6.0 p -147.12 162.81 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.108 -0.995 . . . . 0.0 110.647 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . 0.452 ' N ' HG22 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -139.25 -179.63 5.98 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.439 -0.788 . . . . 0.0 109.997 -179.817 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.808 HG23 ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -108.08 167.72 9.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.159 -0.963 . . . . 0.0 110.354 -179.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.79 177.71 43.1 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . 0.441 ' CD2' ' HE2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.81 135.86 21.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.37 -1.077 . . . . 0.0 110.114 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.525 ' HG3' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -117.87 153.86 32.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.253 -0.904 . . . . 0.0 110.269 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.8 p -125.35 100.73 6.64 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.285 -0.884 . . . . 0.0 110.176 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.4 tt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.19 -179.966 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . 0.425 ' SD ' ' CE2' ' B' ' 78' ' ' PHE . 71.3 mtp . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.164 0.507 . . . . 0.0 110.081 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 29.2 p -145.34 143.39 20.09 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.17 -0.956 . . . . 0.0 110.343 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.491 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.8 Cg_endo -92.49 155.9 3.0 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.068 1.562 . . . . 0.0 110.214 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.476 HD13 ' HG3' ' B' ' 79' ' ' MET . 11.2 pt -144.23 166.36 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 110.501 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.685 HG13 HG21 ' B' ' 74' ' ' VAL . 24.5 t -145.77 124.07 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.264 -0.898 . . . . 0.0 110.03 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.503 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.2 OUTLIER -105.59 111.11 23.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 110.343 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.952 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.8 tp -113.32 150.13 32.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 110.138 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.738 ' O ' HG23 ' B' ' 72' ' ' ILE . 8.5 ttpp -142.04 169.98 16.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.278 -0.889 . . . . 0.0 110.312 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.472 ' O ' HD11 ' B' ' 14' ' ' LEU . . . 151.96 -179.98 28.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -65.07 137.85 57.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.204 -1.174 . . . . 0.0 110.199 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.43 -31.9 16.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.262 -0.899 . . . . 0.0 110.573 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -70.92 -55.16 9.01 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.273 -0.892 . . . . 0.0 110.846 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.404 ' O ' HD13 ' B' ' 17' ' ' LEU . 5.3 m -57.5 -20.96 34.7 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.179 -0.951 . . . . 0.0 110.391 -179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . 0.472 HD11 ' O ' ' B' ' 9' ' ' GLY . 19.3 mt -90.15 -24.8 20.96 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp -58.91 -42.68 90.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.338 -0.851 . . . . 0.0 110.251 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.466 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.8 t -69.6 -34.98 74.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.417 -0.802 . . . . 0.0 110.36 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.404 HD13 ' O ' ' B' ' 13' ' ' THR . 5.5 mp -58.69 -53.64 56.13 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.343 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.2 ttp85 -44.59 -23.44 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.217 -0.927 . . . . 0.0 110.728 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.466 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 85.8 t80 -64.51 -43.43 94.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.022 -1.049 . . . . 0.0 109.852 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 7.8 mtp85 -61.97 -27.51 68.9 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.391 -0.818 . . . . 0.0 109.987 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.56 -16.99 64.57 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.283 -0.886 . . . . 0.0 110.268 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -63.47 -56.07 19.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.0 109.806 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . 0.451 ' N ' ' HD3' ' B' ' 23' ' ' LYS . 0.0 OUTLIER -75.07 -24.91 58.27 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 109.875 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.65 ' CA ' HD13 ' B' ' 27' ' ' LEU . 18.7 m170 -94.93 32.89 1.57 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.413 -0.805 . . . . 0.0 110.106 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.528 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 24.8 p -57.19 -23.6 48.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 0.0 110.395 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . 0.42 HG22 ' H ' ' B' ' 26' ' ' THR . 2.7 t -97.26 13.42 29.53 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 110.674 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.65 HD13 ' CA ' ' B' ' 24' ' ' HIS . 3.2 mp -92.35 -26.39 18.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.528 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 33.9 p90 -118.36 167.97 11.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.11 -0.994 . . . . 0.0 109.979 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.489 ' N ' ' O ' ' B' ' 52' ' ' THR . 3.7 m -100.29 -34.23 10.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.203 -0.936 . . . . 0.0 110.492 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . 0.558 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.52 116.37 2.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.21 -0.931 . . . . 0.0 110.624 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.515 HG13 ' O ' ' A' ' 38' ' ' THR . 14.5 p -90.02 129.89 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 110.005 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.693 ' O ' HG13 ' B' ' 49' ' ' VAL . 2.1 t -87.54 148.41 24.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.41 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.5 p -61.07 166.99 3.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.413 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.99 120.77 14.79 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.287 -0.883 . . . . 0.0 110.423 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.479 ' CE3' ' OG ' ' A' ' 32' ' ' SER . 37.2 p-90 -146.58 175.26 10.72 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.224 -0.922 . . . . 0.0 109.932 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.509 ' HB3' ' HA ' ' B' ' 47' ' ' ALA . 16.7 p-80 -162.5 172.97 14.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.092 -1.005 . . . . 0.0 110.724 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.429 ' CH2' HG23 ' A' ' 52' ' ' THR . 92.7 m95 -79.45 124.57 28.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.502 -0.749 . . . . 0.0 110.078 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . 0.641 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.0 t . . . . . 0 N--CA 1.492 1.653 0 O-C-N 121.256 -0.902 . . . . 0.0 110.318 179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.509 ' HA ' ' HB3' ' B' ' 36' ' ' HIS . . . . . . . . 0 N--CA 1.493 1.723 0 CA-C-O 121.243 0.544 . . . . 0.0 110.657 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.952 HG23 ' O ' ' B' ' 7' ' ' LEU . 46.7 mt -142.06 130.31 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.376 -0.828 . . . . 0.0 110.101 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . 0.693 HG13 ' O ' ' B' ' 32' ' ' SER . 4.2 t -117.34 125.96 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.884 . . . . 0.0 110.177 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 88.0 m -93.79 157.5 16.11 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 mt -135.09 128.36 32.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 110.286 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.558 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 30.7 p -97.22 132.2 43.21 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.279 -0.888 . . . . 0.0 110.276 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' B' ' 53' ' ' TYR . 49.0 m-85 -113.01 150.36 32.04 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.288 -0.882 . . . . 0.0 110.021 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -75.13 -7.22 53.17 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.895 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 24.9 p -170.72 157.72 5.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.317 -0.864 . . . . 0.0 110.283 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.46 -38.21 90.24 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.265 -0.897 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 8.5 t-105 -53.83 -53.72 48.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.363 -0.836 . . . . 0.0 110.447 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -57.74 -35.43 70.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.473 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . 0.804 ' NH2' HG23 ' B' ' 76' ' ' THR . 23.3 ttt180 -58.94 -42.81 90.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.075 -1.016 . . . . 0.0 110.123 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.41 -34.48 75.45 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.322 -0.861 . . . . 0.0 110.333 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -65.77 -45.26 83.16 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.248 -0.908 . . . . 0.0 110.393 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.652 ' O ' HG13 ' B' ' 66' ' ' VAL . 3.2 t80 -56.1 -49.66 73.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.281 -0.887 . . . . 0.0 110.763 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.567 ' HA ' HG22 ' B' ' 66' ' ' VAL . 97.5 mt -59.22 -46.15 89.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.192 -0.942 . . . . 0.0 110.746 -179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.18 -20.7 66.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.204 -0.935 . . . . 0.0 110.436 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -95.7 -17.95 20.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.275 -0.89 . . . . 0.0 110.392 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.718 HG23 ' O ' ' B' ' 66' ' ' VAL . 12.4 m -107.87 114.22 45.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.244 -0.91 . . . . 0.0 110.328 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.41 115.94 11.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.045 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.637 HD11 HD11 ' B' ' 7' ' ' LEU . 4.1 tp -88.07 143.65 33.33 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.198 -0.939 . . . . 0.0 110.264 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.587 ' CG ' HD12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -95.71 161.83 1.45 Allowed 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.059 1.557 . . . . 0.0 110.344 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -65.23 -16.3 63.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.302 -0.874 . . . . 0.0 110.251 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 40.7 m -84.88 -31.35 23.77 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.256 -0.903 . . . . 0.0 110.463 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.738 HG23 ' O ' ' B' ' 8' ' ' LYS . 70.4 mt -93.65 148.83 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.157 -0.964 . . . . 0.0 110.599 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 90.9 m -145.5 154.14 41.89 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.354 -0.842 . . . . 0.0 110.028 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.685 HG21 HG13 ' B' ' 5' ' ' VAL . 6.1 p -147.22 162.81 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.112 -0.992 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . 0.45 ' N ' HG22 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -139.16 -179.86 6.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.375 -0.828 . . . . 0.0 109.955 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . 0.804 HG23 ' NH2' ' B' ' 59' ' ' ARG . 0.2 OUTLIER -107.72 167.47 9.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 0.0 110.435 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.24 177.5 42.88 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . 0.425 ' CE2' ' SD ' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.73 135.95 21.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.26 -1.141 . . . . 0.0 110.111 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.476 ' HG3' HD13 ' B' ' 4' ' ' ILE . 0.2 OUTLIER -117.94 154.24 32.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 110.281 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.5 p -125.5 100.69 6.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 110.132 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.25 -179.918 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtp . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.279 0.562 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.37 160.46 25.96 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.863 . . . . 0.0 109.989 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' PRO . . . . . 0.51 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 51.8 Cg_endo -114.82 159.16 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 123.885 1.466 . . . . 0.0 110.09 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 pt -144.49 164.37 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 110.221 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.443 HG21 ' CE1' ' A' ' 53' ' ' TYR . 97.8 t -145.94 127.64 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' HIS . . . . . 0.488 ' HB2' ' CE ' ' B' ' 79' ' ' MET . 0.1 OUTLIER -105.63 115.81 30.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.0 110.473 -179.673 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.912 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.6 OUTLIER -118.53 149.76 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.382 -0.824 . . . . 0.0 109.909 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.721 ' O ' HG23 ' A' ' 72' ' ' ILE . 7.4 ttpt -142.72 171.89 13.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.043 -1.036 . . . . 0.0 110.637 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLY . . . . . 0.466 ' HA3' HG12 ' A' ' 72' ' ' ILE . . . 151.51 173.86 21.75 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -64.99 138.23 58.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.16 -1.2 . . . . 0.0 110.056 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.29 -25.56 3.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.25 -0.906 . . . . 0.0 110.691 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' A' ' 15' ' ' LYS . 25.9 t30 -65.55 -61.36 2.14 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.961 . . . . 0.0 110.598 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' THR . . . . . 0.534 ' HB ' HD11 ' A' ' 72' ' ' ILE . 0.2 OUTLIER -57.87 -32.47 67.71 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.101 -0.999 . . . . 0.0 110.338 -179.769 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -67.75 -30.29 69.72 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 0.0 110.01 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 10.0 mmtp -59.99 -45.61 92.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.216 -0.928 . . . . 0.0 110.149 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.531 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 5.7 t -70.08 -36.56 75.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.472 -0.767 . . . . 0.0 110.739 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.9 -56.69 19.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.899 -1.125 . . . . 0.0 110.668 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -47.08 -21.33 0.22 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.676 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.531 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 91.0 t80 -64.27 -27.25 68.91 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.006 -1.059 . . . . 0.0 109.818 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 -79.6 -31.9 41.8 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.264 -0.898 . . . . 0.0 109.882 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 8.8 m-30 -66.33 -14.93 62.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -0.863 . . . . 0.0 110.101 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -63.43 -55.67 22.38 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.494 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 1.8 mptt -75.18 -22.7 57.84 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' HIS . . . . . 0.664 ' HB3' HD22 ' A' ' 27' ' ' LEU . 11.3 m170 -95.04 38.93 1.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.264 -0.897 . . . . 0.0 110.172 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' CYS . . . . . 0.516 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 25.1 p -57.0 -25.43 58.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.358 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.8 t -97.49 11.34 37.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.268 -0.895 . . . . 0.0 110.76 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.664 HD22 ' HB3' ' A' ' 24' ' ' HIS . 3.0 mp -92.33 -32.41 15.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.083 -1.011 . . . . 0.0 110.355 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' TYR . . . . . 0.516 ' CE1' ' HA ' ' A' ' 25' ' ' CYS . 50.6 p90 -113.38 171.74 7.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.189 -0.945 . . . . 0.0 109.615 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.48 ' HB ' ' O ' ' A' ' 52' ' ' THR . 61.7 m -101.16 -36.22 9.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.056 -1.028 . . . . 0.0 111.064 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.4 122.54 3.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.023 -1.048 . . . . 0.0 110.798 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.683 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.0 p -88.16 108.16 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.162 -0.961 . . . . 0.0 109.891 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . 0.54 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -63.46 146.55 53.4 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.423 -0.798 . . . . 0.0 110.99 -179.403 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . 0.443 ' HB3' ' CG2' ' B' ' 38' ' ' THR . 36.3 p -61.58 163.41 7.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.403 -0.811 . . . . 0.0 110.258 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 115.62 7.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.321 -0.862 . . . . 0.0 110.647 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CB ' ' HB3' ' B' ' 35' ' ' TRP . 16.5 p-90 -146.92 168.66 20.92 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.267 -0.896 . . . . 0.0 110.091 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.546 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 14.2 p-80 -162.47 178.48 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . 0.633 ' CH2' HG23 ' B' ' 52' ' ' THR . 80.4 m95 -79.73 125.18 29.33 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.551 -0.718 . . . . 0.0 110.467 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 t . . . . . 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.918 . . . . 0.0 110.271 179.832 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ALA . . . . . 0.48 ' C ' HG13 ' A' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.49 1.564 0 CA-C-O 121.228 0.537 . . . . 0.0 110.165 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ILE . . . . . 0.912 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.7 mt -140.83 131.34 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.271 -0.893 . . . . 0.0 110.262 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 52.9 t -110.48 117.18 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.308 -0.87 . . . . 0.0 110.691 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.41 ' O ' ' HB3' ' A' ' 32' ' ' SER . 96.2 m -94.14 153.81 17.91 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.21 -0.931 . . . . 0.0 109.626 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.8 mp -136.31 131.2 34.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.931 -1.106 . . . . 0.0 110.497 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.664 HG23 ' CH2' ' B' ' 37' ' ' TRP . 7.6 p -97.34 135.07 39.77 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.394 -0.816 . . . . 0.0 110.042 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 3' ' ' PRO . 88.8 m-85 -111.23 148.75 32.16 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.136 -0.978 . . . . 0.0 110.396 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -81.97 -8.79 59.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.213 -0.93 . . . . 0.0 110.151 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.94 138.45 6.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.334 -0.854 . . . . 0.0 110.196 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -54.79 -39.2 68.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.252 -0.905 . . . . 0.0 110.266 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.77 -51.74 62.45 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 51.3 tt0 -57.12 -40.79 77.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.359 -0.838 . . . . 0.0 110.743 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -59.18 -36.87 76.1 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.036 -1.04 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.08 -44.5 97.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.947 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLN . . . . . 0.507 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 47.8 mt-30 -65.61 -39.0 91.06 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.124 -0.985 . . . . 0.0 110.619 -179.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' PHE . . . . . 0.648 ' O ' HG22 ' A' ' 66' ' ' VAL . 3.0 t80 -54.85 -48.21 73.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.163 -0.961 . . . . 0.0 110.221 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -59.8 -25.95 65.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.191 -0.943 . . . . 0.0 110.163 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.78 -20.41 42.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.299 -0.875 . . . . 0.0 110.628 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 9.1 mm-40 -96.18 -20.58 18.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.159 -0.963 . . . . 0.0 110.418 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' VAL . . . . . 0.648 HG22 ' O ' ' A' ' 62' ' ' PHE . 32.2 m -103.24 118.96 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.247 -0.908 . . . . 0.0 110.413 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -78.31 114.09 16.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ILE . . . . . 0.439 HD11 HD11 ' A' ' 7' ' ' LEU . 3.5 tp -88.52 137.42 30.52 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.296 -0.878 . . . . 0.0 110.053 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' A' ' 72' ' ' ILE . 46.7 Cg_endo -98.82 159.95 0.68 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.894 1.47 . . . . 0.0 110.329 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.82 -13.04 8.8 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.238 -0.914 . . . . 0.0 110.157 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 94.5 m -84.28 -38.01 20.99 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.265 -0.897 . . . . 0.0 110.028 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' ILE . . . . . 0.721 HG23 ' O ' ' A' ' 8' ' ' LYS . 72.4 mt -93.97 149.48 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.314 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 23.4 m -144.9 153.82 41.97 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.235 -0.915 . . . . 0.0 110.029 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.737 ' HB ' HD12 ' A' ' 7' ' ' LEU . 3.3 p -146.54 159.47 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.664 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.54 -179.36 5.86 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.386 -0.821 . . . . 0.0 110.164 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 m -107.93 170.88 7.72 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.177 -0.952 . . . . 0.0 110.719 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.37 -178.57 40.72 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.1 138.0 22.53 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.237 -1.155 . . . . 0.0 110.246 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' MET . . . . . 0.537 ' CE ' ' HB2' ' B' ' 6' ' ' HIS . 0.9 OUTLIER -121.06 170.71 9.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.243 -0.911 . . . . 0.0 110.092 179.847 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' SER . . . . . 0.422 ' O ' ' OG ' ' A' ' 80' ' ' SER . 1.3 p -137.73 103.92 5.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 110.408 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.541 ' O ' ' CG1' ' A' ' 81' ' ' ILE . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.114 -0.946 . . . . 0.0 109.976 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 64.8 mtp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.27 0.557 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.67 160.96 24.27 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 110.063 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . 0.515 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 49.9 Cg_endo -115.53 158.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 123.894 1.471 . . . . 0.0 110.04 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 4' ' ' ILE . . . . . 0.404 ' C ' HG23 ' B' ' 5' ' ' VAL . 5.0 pt -144.49 164.01 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 110.367 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' VAL . . . . . 0.469 HG21 ' CE1' ' B' ' 53' ' ' TYR . 98.0 t -145.84 127.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 109.955 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' HIS . . . . . 0.537 ' HB2' ' CE ' ' A' ' 79' ' ' MET . 0.1 OUTLIER -105.47 116.1 31.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.232 -0.917 . . . . 0.0 110.537 -179.642 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' LEU . . . . . 0.893 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.6 OUTLIER -118.56 149.69 40.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.779 179.652 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' LYS . . . . . 0.743 ' O ' HG23 ' B' ' 72' ' ' ILE . 7.3 ttpt -142.43 172.31 12.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.076 -1.015 . . . . 0.0 110.461 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' GLY . . . . . 0.474 ' HA3' HG12 ' B' ' 72' ' ' ILE . . . 150.82 174.1 21.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 36.5 m-20 -65.08 138.55 58.39 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.152 -1.205 . . . . 0.0 110.252 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.47 -25.16 3.68 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' B' ' 15' ' ' LYS . 26.4 t30 -66.54 -61.49 1.96 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 0.0 110.692 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' THR . . . . . 0.522 ' HB ' HD11 ' B' ' 72' ' ' ILE . 0.2 OUTLIER -57.77 -31.72 66.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.053 -1.029 . . . . 0.0 110.388 -179.841 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.24 -30.55 69.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.184 -0.947 . . . . 0.0 110.008 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' B' ' 12' ' ' ASN . 10.2 mmtp -59.65 -45.45 91.97 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.19 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' CYS . . . . . 0.536 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 5.8 t -70.09 -36.25 74.77 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.881 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' LEU . . . . . 0.411 ' HA ' HD12 ' B' ' 17' ' ' LEU . 1.6 mp -58.94 -56.91 16.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.978 -1.076 . . . . 0.0 110.648 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 12.9 ttp85 -47.1 -21.43 0.24 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.263 -0.898 . . . . 0.0 110.655 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' TYR . . . . . 0.536 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 91.5 t80 -64.19 -27.23 68.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.072 -1.017 . . . . 0.0 109.759 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -79.77 -31.66 40.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.354 -0.841 . . . . 0.0 109.836 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . 0.554 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.4 m-30 -66.44 -15.01 63.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.289 -0.882 . . . . 0.0 110.068 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -63.36 -55.94 20.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . 0.497 ' N ' ' HD3' ' B' ' 23' ' ' LYS . 1.7 mptt -75.05 -22.59 58.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.216 -0.928 . . . . 0.0 110.252 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' HIS . . . . . 0.676 ' HB3' HD22 ' B' ' 27' ' ' LEU . 12.8 m170 -95.01 38.63 1.12 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' CYS . . . . . 0.555 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 25.1 p -57.13 -25.45 58.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.183 -0.948 . . . . 0.0 110.521 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 14.9 t -97.57 11.37 37.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.191 -0.943 . . . . 0.0 110.615 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' LEU . . . . . 0.676 HD22 ' HB3' ' B' ' 24' ' ' HIS . 3.3 mp -92.3 -32.23 15.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.136 -0.978 . . . . 0.0 110.32 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' TYR . . . . . 0.555 ' CE1' ' HA ' ' B' ' 25' ' ' CYS . 50.2 p90 -113.49 172.06 7.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.236 -0.915 . . . . 0.0 109.665 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' THR . . . . . 0.475 ' HB ' ' O ' ' B' ' 52' ' ' THR . 57.3 m -101.49 -36.37 8.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.035 -1.04 . . . . 0.0 111.065 -179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.39 122.46 3.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.043 -1.035 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' VAL . . . . . 0.678 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.1 p -88.15 109.57 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.276 -0.89 . . . . 0.0 109.816 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . 0.565 ' HB2' ' CZ3' ' A' ' 37' ' ' TRP . 0.3 OUTLIER -64.88 146.87 54.32 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.427 -0.796 . . . . 0.0 111.173 -179.254 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 78.4 p -61.41 163.06 7.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.373 -0.83 . . . . 0.0 110.081 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.25 115.77 8.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.338 -0.851 . . . . 0.0 110.512 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' TRP . . . . . 0.58 ' HB3' ' CB ' ' A' ' 35' ' ' TRP . 17.7 p-90 -146.99 168.97 20.2 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.126 -0.984 . . . . 0.0 110.13 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' HIS . . . . . 0.518 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 12.7 p-80 -162.6 178.54 8.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 110.734 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' TRP . . . . . 0.664 ' CH2' HG23 ' A' ' 52' ' ' THR . 79.5 m95 -79.72 125.05 29.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.487 -0.758 . . . . 0.0 110.218 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' THR . . . . . 0.443 ' CG2' ' HB3' ' A' ' 33' ' ' SER . 6.8 t . . . . . 0 N--CA 1.491 1.613 0 O-C-N 121.313 -0.867 . . . . 0.0 110.254 -179.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' ALA . . . . . 0.487 ' C ' HG13 ' B' ' 48' ' ' ILE . . . . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.309 0.576 . . . . 0.0 110.091 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 7' ' ' LEU . 44.2 mt -140.74 131.89 29.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.208 -0.932 . . . . 0.0 110.2 -179.134 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 53.7 t -111.11 116.64 53.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.21 -0.931 . . . . 0.0 110.53 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' THR . . . . . 0.414 ' O ' ' HB3' ' B' ' 32' ' ' SER . 98.2 m -93.72 154.03 18.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -0.894 . . . . 0.0 109.535 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 mp -136.17 131.44 34.65 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 110.54 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' THR . . . . . 0.633 HG23 ' CH2' ' A' ' 37' ' ' TRP . 9.1 p -97.62 135.3 39.64 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.273 -0.892 . . . . 0.0 110.028 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 91.1 m-85 -111.46 148.7 32.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.085 -1.009 . . . . 0.0 110.354 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -82.46 -8.65 59.61 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.14 -0.975 . . . . 0.0 110.045 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.16 138.34 7.73 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 110.147 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -55.25 -39.25 69.55 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.339 -0.851 . . . . 0.0 110.169 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.71 -52.06 61.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 110.14 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 52.1 tt0 -57.07 -41.04 78.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.411 -0.805 . . . . 0.0 110.751 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -59.02 -36.2 74.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.977 -1.077 . . . . 0.0 110.267 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.272 -0.893 . . . . 0.0 110.984 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 47.5 mt-30 -65.42 -38.55 90.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.599 -179.334 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' PHE . . . . . 0.632 ' O ' HG22 ' B' ' 66' ' ' VAL . 4.0 t80 -54.85 -48.18 73.23 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.64 -25.79 64.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.215 -0.928 . . . . 0.0 110.388 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.22 -20.42 41.11 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.325 -0.859 . . . . 0.0 110.505 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' B' ' 61' ' ' GLN . 8.9 mm-40 -96.4 -19.31 19.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.286 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' VAL . . . . . 0.632 HG22 ' O ' ' B' ' 62' ' ' PHE . 30.1 m -104.9 118.38 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.2 -0.937 . . . . 0.0 110.232 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -77.94 114.51 16.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.268 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' ILE . . . . . 0.438 HD11 HD11 ' B' ' 7' ' ' LEU . 3.3 tp -88.74 137.26 30.19 Favored Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.228 -0.92 . . . . 0.0 110.151 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' PRO . . . . . 0.459 ' HD2' ' HB ' ' B' ' 72' ' ' ILE . 47.8 Cg_endo -98.43 160.25 0.76 Allowed 'Trans proline' 0 C--N 1.303 -1.832 0 O-C-N 123.911 1.48 . . . . 0.0 110.212 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.03 -12.95 9.31 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.16 -0.962 . . . . 0.0 110.12 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 87.1 m -84.49 -38.24 20.34 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 110.118 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' ILE . . . . . 0.743 HG23 ' O ' ' B' ' 8' ' ' LYS . 78.9 mt -93.81 149.76 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.219 -0.925 . . . . 0.0 110.229 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.4 m -144.87 153.87 42.04 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.33 -0.857 . . . . 0.0 110.147 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' VAL . . . . . 0.718 ' HB ' HD12 ' B' ' 7' ' ' LEU . 3.3 p -146.4 159.66 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.179 -0.95 . . . . 0.0 110.642 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 -179.55 6.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.418 -0.801 . . . . 0.0 110.04 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.5 m -107.8 170.93 7.69 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.081 -1.012 . . . . 0.0 110.715 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.5 -178.91 41.02 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -147.79 138.18 23.02 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -1.137 . . . . 0.0 110.34 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' MET . . . . . 0.488 ' CE ' ' HB2' ' A' ' 6' ' ' HIS . 0.5 OUTLIER -121.4 170.46 9.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.379 -0.825 . . . . 0.0 110.053 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' B' ' 80' ' ' SER . 1.3 p -137.64 104.24 5.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.17 -0.956 . . . . 0.0 110.341 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' ILE . . . . . 0.55 ' CG1' ' O ' ' B' ' 81' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.126 -0.984 . . . . 0.0 109.965 179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 4.4 mtm . . . . . 0 N--CA 1.492 1.641 0 CA-C-O 121.251 0.548 . . . . 0.0 110.163 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.44 122.39 61.24 Favored Pre-proline 0 N--CA 1.492 1.65 0 O-C-N 121.207 -0.933 . . . . 0.0 110.373 -179.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.5 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -68.96 146.52 65.44 Favored 'Trans proline' 0 C--N 1.305 -1.727 0 O-C-N 124.063 1.56 . . . . 0.0 110.197 179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.422 ' CG1' ' O ' ' A' ' 4' ' ' ILE . 1.7 pp -143.98 117.38 3.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.168 -0.957 . . . . 0.0 110.364 -179.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 61.4 t -94.13 153.38 3.43 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.175 -0.953 . . . . 0.0 109.999 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.585 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -134.96 117.59 15.96 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.253 -0.904 . . . . 0.0 109.85 179.859 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.65 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.0 OUTLIER -113.66 148.65 35.93 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.311 -0.868 . . . . 0.0 110.199 -179.803 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.529 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 16.6 tttm -142.72 168.1 20.52 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.336 -0.853 . . . . 0.0 110.225 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.529 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 151.11 -156.38 26.64 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.542 -1.423 . . . . 0.0 109.542 179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 54.5 m-20 -65.14 127.57 32.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.238 -1.154 . . . . 0.0 110.342 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.579 ' HB3' ' HD3' ' A' ' 45' ' ' LYS . . . -50.19 -27.03 5.25 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.243 -0.911 . . . . 0.0 110.099 179.794 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 44.6 m-80 -77.75 -45.67 23.99 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.279 -0.888 . . . . 0.0 110.29 179.944 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 28.2 m -57.89 -21.76 44.88 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.163 -0.961 . . . . 0.0 110.086 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.987 ' HA ' HD12 ' A' ' 17' ' ' LEU . 30.6 mt -76.62 -29.69 56.59 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.872 . . . . 0.0 110.343 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 25.8 ttmt -60.18 -39.46 86.54 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.229 -0.919 . . . . 0.0 110.59 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 32.1 t -69.91 -40.31 75.65 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.249 -0.907 . . . . 0.0 110.7 -179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.987 HD12 ' HA ' ' A' ' 14' ' ' LEU . 14.5 mt -58.51 -49.55 76.98 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.143 -0.973 . . . . 0.0 110.334 -179.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.604 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 46.6 ttt-85 -45.04 -37.86 4.45 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.184 -0.948 . . . . 0.0 110.796 -179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.434 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 87.5 t80 -64.56 -41.77 96.09 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.103 -0.998 . . . . 0.0 110.344 -179.688 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 27.7 mtt180 -57.67 -36.5 72.0 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.156 -0.965 . . . . 0.0 109.871 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.604 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 5.8 m-30 -66.79 -18.12 65.22 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.225 -0.922 . . . . 0.0 110.093 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.434 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 28.2 mmtt -63.31 -48.24 78.9 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.278 -0.889 . . . . 0.0 109.954 179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.5 mmtt -74.83 -23.88 58.52 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.231 -0.918 . . . . 0.0 109.5 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.826 ' HB3' HD12 ' A' ' 27' ' ' LEU . 36.7 m170 -95.23 33.92 1.49 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.354 -0.841 . . . . 0.0 109.967 179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.563 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 21.2 p -56.75 -24.63 51.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.257 -0.902 . . . . 0.0 110.07 -179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.684 ' O ' HG23 ' A' ' 26' ' ' THR . 14.1 t -96.9 54.09 1.26 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.269 -0.894 . . . . 0.0 109.771 179.628 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.826 HD12 ' HB3' ' A' ' 24' ' ' HIS . 12.4 mt -147.78 -32.02 0.28 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.338 -0.851 . . . . 0.0 110.755 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.563 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 9.2 p90 -108.76 167.51 10.01 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 120.928 -1.108 . . . . 0.0 110.012 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 15.0 m -100.66 -36.56 9.09 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.091 -1.006 . . . . 0.0 110.88 -179.761 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.1 118.85 2.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.08 -1.013 . . . . 0.0 110.728 -179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.406 ' O ' HG13 ' A' ' 31' ' ' VAL . 9.8 p -89.94 136.06 24.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.266 -0.896 . . . . 0.0 109.935 179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.599 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 28.4 p -96.36 149.83 21.26 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.071 -1.018 . . . . 0.0 110.303 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.31 162.02 8.29 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.333 -0.854 . . . . 0.0 110.22 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 7.0 m -68.0 127.88 34.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.328 -179.989 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.602 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 40.9 p-90 -146.14 179.95 7.14 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.198 -0.939 . . . . 0.0 109.798 179.721 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.579 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 26.7 t-80 -162.71 173.82 13.34 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.988 -1.07 . . . . 0.0 110.863 -179.476 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.579 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 55.9 m95 -78.6 93.35 4.83 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.401 -0.812 . . . . 0.0 109.834 179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 13.6 t -74.18 157.63 35.59 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.312 -0.868 . . . . 0.0 110.42 -179.687 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -171.2 165.67 38.76 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.382 -1.487 . . . . 0.0 109.382 179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -54.35 -45.18 72.67 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.143 -1.21 . . . . 0.0 109.977 179.846 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 15.7 m-80 -112.95 112.91 24.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.341 -0.849 . . . . 0.0 110.161 179.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.431 ' H ' HG23 ' A' ' 42' ' ' VAL . 0.3 OUTLIER -96.89 -167.23 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.228 -0.92 . . . . 0.0 109.789 -179.852 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 17.4 tttt -131.35 -67.38 0.7 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.144 -0.973 . . . . 0.0 110.325 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -154.86 -158.59 0.86 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.222 -0.923 . . . . 0.0 110.11 -179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.579 ' HD3' ' HB3' ' A' ' 11' ' ' ALA . 11.1 mttt -82.87 111.82 19.11 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.231 -0.918 . . . . 0.0 110.186 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.507 ' O ' HG13 ' A' ' 48' ' ' ILE . 60.4 p -141.42 31.52 1.7 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.286 -0.884 . . . . 0.0 110.112 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.465 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -37.2 152.65 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.515 -0.741 . . . . 0.0 110.559 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.65 HG23 ' O ' ' A' ' 7' ' ' LEU . 40.6 mt -142.49 146.86 21.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.272 -0.892 . . . . 0.0 110.115 -179.821 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.21 178.18 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.634 0 O-C-N 121.185 -0.947 . . . . 0.0 110.25 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.543 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 53.9 m -145.91 151.18 37.43 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.267 -0.896 . . . . 0.0 110.159 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.72 128.91 31.8 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -0.998 . . . . 0.0 110.091 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -97.91 134.51 40.94 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.301 -0.874 . . . . 0.0 110.642 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.5 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 54.8 m-85 -112.72 151.51 30.17 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.298 -0.876 . . . . 0.0 110.053 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -76.7 -8.52 57.42 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.126 -0.984 . . . . 0.0 110.622 -179.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 28.8 p -169.55 160.94 9.35 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.05 -1.031 . . . . 0.0 110.561 -179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -68.2 -41.94 80.61 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.203 -0.936 . . . . 0.0 109.932 179.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.48 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 51.7 t-105 -53.51 -52.39 59.77 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.303 -0.873 . . . . 0.0 109.648 179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.469 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 61.7 tt0 -58.74 -30.56 67.59 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.188 -0.945 . . . . 0.0 109.685 179.451 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.1 -48.97 79.67 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.392 -0.817 . . . . 0.0 110.557 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.537 ' OD1' ' N ' ' A' ' 61' ' ' GLN . 2.5 p30 -61.17 -26.54 67.77 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.087 -1.008 . . . . 0.0 110.315 -179.687 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.537 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 67.1 mt-30 -65.95 -52.03 53.31 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.151 -0.968 . . . . 0.0 109.97 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.652 ' O ' HG22 ' A' ' 66' ' ' VAL . 5.7 t80 -55.53 -46.32 77.06 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 109.718 179.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 8.3 mt -59.75 -21.87 61.32 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.33 -0.856 . . . . 0.0 110.198 179.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.91 -17.56 29.33 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.313 -0.867 . . . . 0.0 110.076 179.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.7 mm-40 -94.65 -14.74 24.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.312 -0.867 . . . . 0.0 110.351 -179.53 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.652 HG22 ' O ' ' A' ' 62' ' ' PHE . 20.1 m -130.37 134.81 61.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.64 0 O-C-N 121.247 -0.908 . . . . 0.0 110.137 179.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 14.5 tptp -86.52 120.05 27.43 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.205 -0.934 . . . . 0.0 110.322 -179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.635 HD11 HG23 ' A' ' 66' ' ' VAL . 4.8 mm -88.96 103.6 5.94 Favored Pre-proline 0 N--CA 1.491 1.607 0 O-C-N 121.241 -0.912 . . . . 0.0 109.967 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.73 ' CG ' HD12 ' A' ' 72' ' ' ILE . 46.0 Cg_endo -39.9 154.4 0.05 OUTLIER 'Trans proline' 0 C--N 1.305 -1.761 0 O-C-N 124.094 1.576 . . . . 0.0 110.418 179.867 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.425 ' HB3' ' HE3' ' A' ' 70' ' ' LYS . 13.6 mtpp -70.35 -14.86 62.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.252 -0.905 . . . . 0.0 110.459 -179.784 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.9 m -84.66 -19.32 33.06 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.221 -0.924 . . . . 0.0 110.361 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.73 HD12 ' CG ' ' A' ' 69' ' ' PRO . 23.8 mt -93.81 123.59 45.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.248 -0.908 . . . . 0.0 110.035 179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.6 m -94.7 136.6 34.81 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.458 -0.776 . . . . 0.0 110.416 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.588 HG12 ' N ' ' A' ' 75' ' ' SER . 92.9 t -90.73 171.99 1.04 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.565 -179.307 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.588 ' N ' HG12 ' A' ' 74' ' ' VAL . 0.4 OUTLIER -142.45 152.82 43.13 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.387 -0.821 . . . . 0.0 110.661 -179.931 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.431 ' O ' ' HB3' ' B' ' 80' ' ' SER . 63.5 p -132.97 135.4 45.47 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.273 -0.892 . . . . 0.0 110.15 179.648 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.502 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -174.39 -173.63 40.53 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.757 -1.337 . . . . 0.0 109.757 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.502 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 50.2 m-85 -147.65 151.56 36.39 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.167 -1.196 . . . . 0.0 110.399 -179.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.408 ' CE ' ' CE ' ' B' ' 79' ' ' MET . 25.5 mtt -119.78 174.84 6.19 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.182 -0.949 . . . . 0.0 110.287 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.464 ' C ' HG13 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -140.69 108.72 5.73 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.324 -0.86 . . . . 0.0 109.836 179.797 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.464 HG13 ' C ' ' A' ' 80' ' ' SER . 23.3 mt . . . . . 0 N--CA 1.491 1.609 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.23 -179.721 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 4.7 mtm . . . . . 0 N--CA 1.491 1.611 0 CA-C-O 121.226 0.536 . . . . 0.0 110.264 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -94.5 122.17 61.64 Favored Pre-proline 0 N--CA 1.492 1.665 0 O-C-N 121.161 -0.962 . . . . 0.0 110.44 -179.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.494 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.5 Cg_endo -68.79 146.86 67.62 Favored 'Trans proline' 0 C--N 1.304 -1.811 0 O-C-N 123.978 1.515 . . . . 0.0 110.071 179.719 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.41 ' CG1' ' O ' ' B' ' 4' ' ' ILE . 1.7 pp -144.12 117.22 3.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.118 -0.989 . . . . 0.0 110.297 179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 53.6 t -94.06 152.63 3.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.268 -0.895 . . . . 0.0 110.013 179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.589 ' CB ' ' HB2' ' B' ' 75' ' ' SER . 0.0 OUTLIER -134.45 117.75 16.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.279 -0.888 . . . . 0.0 109.938 179.9 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.654 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.0 OUTLIER -113.86 148.81 36.04 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.292 -0.88 . . . . 0.0 110.284 -179.791 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.513 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 16.5 tttm -142.59 168.34 19.96 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.266 -0.896 . . . . 0.0 110.14 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.513 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 151.12 -156.76 26.84 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.461 -1.455 . . . . 0.0 109.461 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . 0.402 ' HB2' ' OG1' ' B' ' 13' ' ' THR . 53.5 m-20 -64.98 127.31 31.07 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.18 -1.188 . . . . 0.0 110.293 179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.563 ' HB3' ' HD3' ' B' ' 45' ' ' LYS . . . -50.09 -26.86 4.86 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.299 -0.876 . . . . 0.0 110.088 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 43.8 m-80 -77.6 -45.92 23.74 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.19 -0.944 . . . . 0.0 110.219 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.402 ' OG1' ' HB2' ' B' ' 10' ' ' ASP . 28.1 m -57.96 -21.13 42.76 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.26 -0.9 . . . . 0.0 110.089 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 1.007 ' HA ' HD12 ' B' ' 17' ' ' LEU . 31.7 mt -77.24 -29.79 54.2 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.247 -0.908 . . . . 0.0 110.246 179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 25.4 ttmt -60.13 -38.84 84.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.293 -0.879 . . . . 0.0 110.582 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.7 t -70.02 -40.19 75.35 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.192 -0.943 . . . . 0.0 110.8 -179.604 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 1.007 HD12 ' HA ' ' B' ' 14' ' ' LEU . 14.0 mt -58.86 -50.13 75.14 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.128 -0.982 . . . . 0.0 110.349 -179.661 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.594 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 46.5 ttt-85 -44.8 -37.26 3.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.222 -0.924 . . . . 0.0 110.767 -179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.436 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 87.7 t80 -64.97 -41.56 95.33 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 120.991 -1.068 . . . . 0.0 110.239 -179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 27.4 mtt180 -58.21 -36.6 73.37 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.212 -0.93 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.594 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 5.8 m-30 -66.54 -17.8 65.01 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.285 -0.884 . . . . 0.0 110.103 179.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . 0.436 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.1 mmtt -63.39 -48.54 77.43 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.203 -0.936 . . . . 0.0 110.035 179.854 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.6 mmtt -74.66 -23.81 58.72 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.264 -0.898 . . . . 0.0 109.638 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.826 ' HB3' HD12 ' B' ' 27' ' ' LEU . 36.2 m170 -95.23 34.05 1.47 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.347 -0.846 . . . . 0.0 109.832 179.465 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.536 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.2 p -56.74 -24.84 52.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.309 -0.87 . . . . 0.0 110.015 -179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.685 HG23 ' O ' ' B' ' 26' ' ' THR . 14.0 t -96.71 54.06 1.29 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.35 -0.844 . . . . 0.0 109.77 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.826 HD12 ' HB3' ' B' ' 24' ' ' HIS . 12.3 mt -147.76 -32.02 0.28 Allowed 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.335 -0.853 . . . . 0.0 110.788 -179.698 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.536 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 9.1 p90 -108.38 167.53 9.96 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 120.864 -1.148 . . . . 0.0 110.04 179.909 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 18.9 m -100.54 -36.88 9.03 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.193 -0.942 . . . . 0.0 110.698 -179.874 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.87 118.93 2.8 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.054 -1.029 . . . . 0.0 110.733 -179.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . . . . . . . . . 9.8 p -89.95 136.81 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.296 -0.877 . . . . 0.0 109.827 179.302 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.602 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 26.8 p -97.37 150.46 20.97 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.135 -0.978 . . . . 0.0 110.451 -179.846 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -61.36 161.74 8.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.368 -0.833 . . . . 0.0 110.43 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 6.8 m -68.15 127.55 33.31 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.377 -0.827 . . . . 0.0 110.365 179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.599 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 39.8 p-90 -146.26 -179.97 7.1 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.271 -0.893 . . . . 0.0 109.66 179.651 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.575 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 27.5 t-80 -162.57 174.37 12.72 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.931 -1.105 . . . . 0.0 110.67 -179.616 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.575 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 57.1 m95 -78.6 93.54 4.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.484 -0.76 . . . . 0.0 109.806 179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 13.9 t -73.73 157.68 36.04 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.27 -0.894 . . . . 0.0 110.333 -179.698 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -171.54 166.36 39.37 Favored Glycine 0 N--CA 1.489 2.177 0 N-CA-C 109.333 -1.507 . . . . 0.0 109.333 179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -55.98 -43.91 78.06 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.229 -1.16 . . . . 0.0 110.132 -179.927 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 17.1 m-80 -114.24 111.6 21.8 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.235 -0.915 . . . . 0.0 110.061 179.699 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -95.25 -167.56 0.15 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.716 0 O-C-N 121.281 -0.887 . . . . 0.0 110.028 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 16.5 tttt -130.57 -68.44 0.69 Allowed 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.213 -0.93 . . . . 0.0 110.233 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -153.78 -157.74 0.8 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.241 -0.912 . . . . 0.0 110.127 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . 0.563 ' HD3' ' HB3' ' B' ' 11' ' ' ALA . 11.1 mttt -83.6 111.22 18.91 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.221 -0.925 . . . . 0.0 110.176 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.508 ' O ' HG13 ' B' ' 48' ' ' ILE . 61.8 p -140.73 32.25 1.82 Allowed 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.32 -0.862 . . . . 0.0 110.234 -179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.475 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -37.94 152.91 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.488 -0.757 . . . . 0.0 110.66 -179.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.654 HG23 ' O ' ' B' ' 7' ' ' LEU . 38.7 mt -142.75 147.24 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 O-C-N 121.289 -0.882 . . . . 0.0 110.125 -179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -127.95 178.26 4.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.219 -0.926 . . . . 0.0 110.281 -179.92 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.581 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 53.1 m -145.96 151.75 38.3 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.246 -0.909 . . . . 0.0 110.105 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.08 129.12 31.4 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.159 -0.963 . . . . 0.0 110.061 179.863 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 7.3 m -97.95 134.58 40.87 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.28 -0.888 . . . . 0.0 110.602 -179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.5 ' OH ' ' CG ' ' B' ' 62' ' ' PHE . 52.8 m-85 -112.84 151.6 30.2 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.315 -0.865 . . . . 0.0 110.065 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -76.31 -9.2 58.46 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.191 -0.943 . . . . 0.0 110.637 -179.621 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 26.1 p -169.51 160.19 8.95 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.186 -0.946 . . . . 0.0 110.468 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.81 -42.15 86.37 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.196 179.868 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . 0.482 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 50.4 t-105 -53.53 -52.34 59.96 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.243 -0.911 . . . . 0.0 109.669 179.771 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.464 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 63.1 tt0 -58.85 -30.11 67.44 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.243 -0.911 . . . . 0.0 109.721 179.542 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 7.8 ttp180 -59.29 -49.18 78.82 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.339 -0.851 . . . . 0.0 110.464 179.974 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' B' ' 61' ' ' GLN . 2.3 p30 -61.18 -26.61 67.83 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.093 -1.005 . . . . 0.0 110.36 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.53 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 67.2 mt-30 -65.86 -52.09 53.25 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.19 -0.944 . . . . 0.0 109.851 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.661 ' O ' HG22 ' B' ' 66' ' ' VAL . 5.3 t80 -55.47 -46.3 76.87 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.265 -0.897 . . . . 0.0 109.824 179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.2 mt -59.59 -22.07 61.25 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.248 -0.907 . . . . 0.0 110.136 179.796 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -88.71 -17.62 29.55 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.146 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -94.68 -13.96 25.3 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.0 110.293 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.661 HG22 ' O ' ' B' ' 62' ' ' PHE . 22.0 m -131.01 134.63 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.188 -0.945 . . . . 0.0 110.181 179.739 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 14.0 tptp -86.3 120.03 27.21 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.257 -0.902 . . . . 0.0 110.279 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.626 HD11 HG23 ' B' ' 66' ' ' VAL . 4.9 mm -89.02 103.76 6.3 Favored Pre-proline 0 N--CA 1.492 1.649 0 O-C-N 121.244 -0.91 . . . . 0.0 109.979 179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.783 ' CG ' HD12 ' B' ' 72' ' ' ILE . 45.8 Cg_endo -40.38 154.5 0.06 OUTLIER 'Trans proline' 0 C--N 1.305 -1.726 0 O-C-N 124.076 1.566 . . . . 0.0 110.495 -179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 13.5 mtpp -70.5 -14.76 62.65 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.282 -0.886 . . . . 0.0 110.486 -179.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 28.4 m -84.58 -19.05 33.7 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.244 -0.91 . . . . 0.0 110.154 -179.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.783 HD12 ' CG ' ' B' ' 69' ' ' PRO . 27.1 mt -94.32 123.71 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.217 -0.927 . . . . 0.0 110.33 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 24.3 m -94.8 136.64 34.87 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.38 -0.825 . . . . 0.0 110.495 -179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.595 HG12 ' N ' ' B' ' 75' ' ' SER . 99.4 t -90.79 172.07 1.03 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.264 -0.898 . . . . 0.0 110.602 -179.26 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . 0.595 ' N ' HG12 ' B' ' 74' ' ' VAL . 0.4 OUTLIER -142.29 153.56 44.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.358 -0.839 . . . . 0.0 110.658 179.938 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . 0.436 ' O ' ' HB3' ' A' ' 80' ' ' SER . 52.5 p -133.56 135.74 44.5 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.288 -0.883 . . . . 0.0 109.967 179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.529 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -174.61 -173.61 40.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.609 -1.396 . . . . 0.0 109.609 -179.961 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.529 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 48.9 m-85 -147.81 149.92 33.24 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.301 -1.117 . . . . 0.0 110.33 -179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.408 ' CE ' ' CE ' ' A' ' 79' ' ' MET . 26.0 mtt -118.69 173.22 6.98 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.226 -0.921 . . . . 0.0 110.351 -179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.477 ' C ' HG13 ' B' ' 81' ' ' ILE . 0.1 OUTLIER -139.43 107.95 5.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.249 -0.907 . . . . 0.0 110.086 179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.477 HG13 ' C ' ' B' ' 80' ' ' SER . 29.7 mt . . . . . 0 N--CA 1.491 1.584 0 CA-C-O 118.071 -0.966 . . . . 0.0 110.169 -179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 6.4 mmm . . . . . 0 N--CA 1.493 1.696 0 CA-C-O 121.327 0.584 . . . . 0.0 110.184 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.572 ' O ' HG23 ' A' ' 2' ' ' THR . 14.8 t -88.42 125.96 61.84 Favored Pre-proline 0 N--CA 1.492 1.632 0 O-C-N 121.256 -0.903 . . . . 0.0 110.413 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.55 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -63.45 152.29 80.81 Favored 'Trans proline' 0 C--N 1.306 -1.706 0 O-C-N 124.124 1.592 . . . . 0.0 110.209 179.694 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.418 ' C ' HG23 ' A' ' 5' ' ' VAL . 11.1 pt -144.16 164.04 14.38 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.738 0 O-C-N 121.211 -0.931 . . . . 0.0 110.378 -179.894 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.418 HG23 ' C ' ' A' ' 4' ' ' ILE . 41.3 t -146.14 136.88 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.159 -0.963 . . . . 0.0 110.548 -179.891 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.604 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.3 OUTLIER -105.2 131.38 52.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.231 -0.918 . . . . 0.0 109.599 179.449 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.508 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.4 OUTLIER -122.45 139.66 53.62 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.139 -0.976 . . . . 0.0 110.771 -179.407 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.499 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 80.6 tttt -142.3 170.85 14.94 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.297 -0.877 . . . . 0.0 110.164 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.499 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.44 -160.55 29.28 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 109.619 -1.393 . . . . 0.0 109.619 179.953 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.469 ' HB3' ' HB ' ' A' ' 13' ' ' THR . 47.0 t0 -64.86 130.54 43.85 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.257 -1.143 . . . . 0.0 110.336 -179.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.1 -30.77 11.72 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.302 -0.873 . . . . 0.0 110.464 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 62.6 t-20 -83.61 -48.39 10.26 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.263 -0.898 . . . . 0.0 110.527 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.469 ' HB ' ' HB3' ' A' ' 10' ' ' ASP . 91.7 m -57.88 -14.96 7.08 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.172 -0.955 . . . . 0.0 110.494 -179.812 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.603 HD23 HD12 ' A' ' 17' ' ' LEU . 64.2 mt -82.48 -32.42 28.85 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.151 -0.968 . . . . 0.0 110.309 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -59.23 -36.62 75.76 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.239 -0.913 . . . . 0.0 110.031 -179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.443 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.7 t -70.11 -34.67 73.39 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.288 -0.883 . . . . 0.0 110.048 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.603 HD12 HD23 ' A' ' 14' ' ' LEU . 13.3 mt -58.77 -50.62 73.26 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.232 -0.917 . . . . 0.0 109.939 179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.575 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 34.5 ttt180 -46.23 -30.65 2.09 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.283 -0.885 . . . . 0.0 109.883 179.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.467 ' O ' ' HB2' ' A' ' 22' ' ' LYS . 28.2 t80 -65.01 -46.55 80.9 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.399 -0.813 . . . . 0.0 110.382 -179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -60.34 -34.29 73.63 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.225 -0.922 . . . . 0.0 110.316 -179.708 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.575 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.5 m-30 -66.38 -22.6 66.25 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.26 -0.9 . . . . 0.0 110.377 -179.798 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.467 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 29.5 mmtt -63.62 -29.93 71.11 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.244 -0.91 . . . . 0.0 110.336 -179.856 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 7.1 mmtt -74.84 -47.75 28.72 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.221 -0.924 . . . . 0.0 110.11 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.5 ' HB3' HD22 ' A' ' 27' ' ' LEU . 16.0 m-70 -95.15 41.3 1.1 Allowed 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.31 -0.869 . . . . 0.0 109.965 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.578 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 24.5 p -56.8 -19.15 15.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.226 -0.921 . . . . 0.0 110.19 -179.949 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.528 HG22 ' O ' ' A' ' 26' ' ' THR . 89.7 m -97.17 6.43 48.48 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.327 -0.858 . . . . 0.0 110.284 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.545 HD23 ' HA ' ' A' ' 62' ' ' PHE . 0.8 OUTLIER -92.19 -7.67 47.67 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.291 -0.88 . . . . 0.0 110.187 -179.754 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.578 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 7.3 p90 -141.7 -176.76 4.88 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.343 -0.848 . . . . 0.0 110.027 -179.607 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.432 HG22 ' N ' ' A' ' 30' ' ' ALA . 1.3 m -94.84 -62.83 1.25 Allowed 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.227 -0.921 . . . . 0.0 109.191 179.911 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.432 ' N ' HG22 ' A' ' 29' ' ' THR . . . -157.18 143.86 18.25 Favored 'General case' 0 C--N 1.304 -1.398 0 O-C-N 120.929 -1.107 . . . . 0.0 108.72 -179.944 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.616 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.7 p -90.02 110.76 22.31 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.9 0 O-C-N 121.639 -0.663 . . . . 0.0 110.325 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.587 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -53.24 146.15 12.45 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.213 -0.929 . . . . 0.0 110.009 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.55 ' HB2' ' CG2' ' B' ' 38' ' ' THR . 7.0 t -60.9 160.82 9.06 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.204 -0.935 . . . . 0.0 110.048 -179.988 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.7 m -67.75 122.07 17.31 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.31 -0.869 . . . . 0.0 110.525 -179.715 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.591 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 25.4 p-90 -147.1 166.7 26.11 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.208 -0.932 . . . . 0.0 109.83 179.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.497 ' ND1' ' HB2' ' A' ' 46' ' ' SER . 11.2 t-80 -162.58 -173.52 3.58 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.042 -1.036 . . . . 0.0 110.779 179.781 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.415 ' H ' ' CG ' ' A' ' 36' ' ' HIS . 19.4 m95 -79.53 101.67 8.39 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.501 -0.75 . . . . 0.0 110.379 -179.657 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.54 ' CG2' ' HB2' ' B' ' 33' ' ' SER . 1.7 t -153.47 141.12 19.95 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.401 -0.812 . . . . 0.0 110.017 179.898 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -67.35 -34.21 84.48 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.903 -1.279 . . . . 0.0 109.903 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.419 ' O ' ' HB2' ' A' ' 41' ' ' ASN . 0.0 OUTLIER 179.7 -29.46 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.091 -1.24 . . . . 0.0 110.177 -179.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.419 ' HB2' ' O ' ' A' ' 40' ' ' HIS . 8.5 t-20 -176.78 113.12 0.1 Allowed 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.222 -0.923 . . . . 0.0 109.847 -179.743 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -128.66 -179.14 2.78 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.845 0 O-C-N 121.231 -0.918 . . . . 0.0 110.58 -179.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.467 ' O ' ' C ' ' A' ' 44' ' ' HIS . 25.5 mttt -86.79 -49.73 7.24 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.426 -0.796 . . . . 0.0 110.637 -179.746 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.467 ' C ' ' O ' ' A' ' 43' ' ' LYS . 1.8 m80 -36.75 140.94 0.13 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.357 -0.839 . . . . 0.0 110.621 -179.505 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 22.6 mttp -81.83 42.06 0.69 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.417 -0.802 . . . . 0.0 110.723 -179.48 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.497 ' HB2' ' ND1' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -54.04 141.2 29.17 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.104 -0.997 . . . . 0.0 109.999 179.821 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -170.6 117.91 0.51 Allowed 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.147 -0.971 . . . . 0.0 110.475 -179.922 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.508 HG23 ' O ' ' A' ' 7' ' ' LEU . 2.7 mt -140.55 155.6 22.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.275 -0.891 . . . . 0.0 110.297 -179.875 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 59.9 t -138.75 118.47 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.385 -0.822 . . . . 0.0 110.394 -179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.594 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 86.9 m -94.3 158.13 15.72 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.251 -0.905 . . . . 0.0 110.314 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -135.97 134.24 38.41 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.274 -0.892 . . . . 0.0 110.112 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -96.38 123.94 40.21 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.228 -0.92 . . . . 0.0 110.341 -179.903 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.55 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 58.5 m-85 -103.32 146.83 27.88 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.351 -0.843 . . . . 0.0 109.85 179.652 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -79.09 -8.25 58.81 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.203 -0.935 . . . . 0.0 110.658 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.9 p -171.15 134.11 0.9 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.163 -0.961 . . . . 0.0 110.374 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.518 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 44.4 mt-10 -50.08 -37.54 34.16 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.249 -0.907 . . . . 0.0 109.988 179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 35.5 t-105 -53.83 -58.87 5.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.076 -1.015 . . . . 0.0 109.799 179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -58.47 -28.74 65.62 Favored 'General case' 0 N--CA 1.489 1.5 0 O-C-N 121.161 -0.962 . . . . 0.0 110.337 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.518 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 53.6 ttp180 -59.56 -48.38 81.87 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.154 -0.967 . . . . 0.0 110.984 -179.764 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.601 ' HA ' HD21 ' A' ' 63' ' ' LEU . 1.1 p30 -60.93 -33.67 73.52 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.093 -1.004 . . . . 0.0 110.741 -179.18 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.519 ' N ' ' OD1' ' A' ' 60' ' ' ASP . 57.5 mt-30 -65.65 -47.57 75.12 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.148 -0.97 . . . . 0.0 110.271 179.968 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.545 ' HA ' HD23 ' A' ' 27' ' ' LEU . 36.2 t80 -55.8 -65.24 0.63 Allowed 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.38 -0.825 . . . . 0.0 110.664 -179.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.601 HD21 ' HA ' ' A' ' 60' ' ' ASP . 3.0 pp -59.39 -18.33 37.88 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.237 -0.914 . . . . 0.0 110.372 -179.57 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 3.6 t -81.84 -20.68 38.48 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.186 -0.946 . . . . 0.0 110.128 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.52 -73.03 0.6 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.245 -0.909 . . . . 0.0 110.273 -179.844 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.527 HG22 ' O ' ' A' ' 62' ' ' PHE . 34.3 m -48.14 130.18 4.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 O-C-N 121.113 -0.992 . . . . 0.0 109.992 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -73.7 108.43 6.54 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.179 -0.95 . . . . 0.0 110.492 -179.699 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 30.9 mt -89.21 121.37 69.54 Favored Pre-proline 0 N--CA 1.492 1.663 0 O-C-N 121.377 -0.827 . . . . 0.0 110.09 179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 46.4 Cg_endo -56.26 179.01 0.1 Allowed 'Trans proline' 0 C--N 1.304 -1.779 0 O-C-N 123.899 1.473 . . . . 0.0 110.528 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 29.8 mmtt -92.19 -12.43 32.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.282 -0.886 . . . . 0.0 110.133 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.3 m -84.62 -16.69 41.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.249 -0.907 . . . . 0.0 110.305 -179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.522 ' CD1' ' N ' ' A' ' 72' ' ' ILE . 1.2 mp -94.06 119.39 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.243 -0.911 . . . . 0.0 110.041 -179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.56 139.75 30.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.297 -0.877 . . . . 0.0 110.32 -179.878 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.55 HG22 ' N ' ' A' ' 75' ' ' SER . 8.4 p -90.71 170.54 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.245 -0.909 . . . . 0.0 110.46 -179.335 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.616 ' OG ' HG22 ' B' ' 81' ' ' ILE . 0.2 OUTLIER -143.85 158.84 43.42 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.345 -0.847 . . . . 0.0 110.988 179.792 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 69.7 p -133.37 134.19 43.41 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.39 -0.819 . . . . 0.0 109.854 179.261 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -167.75 -168.22 29.56 Favored Glycine 0 N--CA 1.49 2.281 0 N-CA-C 109.417 -1.473 . . . . 0.0 109.417 -179.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -147.78 149.15 31.81 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.232 -1.158 . . . . 0.0 110.334 -179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 24.5 mmm -124.75 154.48 40.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.0 110.092 179.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.516 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.7 OUTLIER -130.23 103.86 6.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.159 -0.963 . . . . 0.0 110.394 -179.812 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.565 HG22 ' OG ' ' B' ' 75' ' ' SER . 13.2 pt . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 117.946 -1.026 . . . . 0.0 110.194 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.6 mmm . . . . . 0 N--CA 1.493 1.697 0 CA-C-O 121.173 0.511 . . . . 0.0 110.128 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.576 ' O ' HG23 ' B' ' 2' ' ' THR . 14.7 t -88.65 125.42 63.14 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.269 -0.894 . . . . 0.0 110.48 -179.838 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.548 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.1 Cg_endo -63.35 152.27 80.78 Favored 'Trans proline' 0 C--N 1.305 -1.728 0 O-C-N 124.051 1.553 . . . . 0.0 110.408 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.436 ' C ' HG23 ' B' ' 5' ' ' VAL . 10.3 pt -144.12 164.39 14.31 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.232 -0.918 . . . . 0.0 110.397 -179.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.436 HG23 ' C ' ' B' ' 4' ' ' ILE . 41.5 t -146.32 137.27 18.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.269 -0.895 . . . . 0.0 110.437 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.618 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.3 OUTLIER -105.4 131.0 53.37 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.349 -0.844 . . . . 0.0 109.582 179.585 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.501 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.4 OUTLIER -122.22 139.85 53.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.065 -1.022 . . . . 0.0 110.703 -179.408 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.491 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 80.5 tttt -142.35 170.43 15.72 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.32 -0.862 . . . . 0.0 110.176 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.491 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.81 -160.5 29.37 Favored Glycine 0 N--CA 1.491 2.361 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . 0.467 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 45.8 t0 -64.94 130.98 45.41 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.264 -1.139 . . . . 0.0 110.372 -179.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.33 -30.93 13.18 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.311 -0.868 . . . . 0.0 110.388 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 64.2 t-20 -83.92 -48.25 10.19 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.264 -0.898 . . . . 0.0 110.508 -179.811 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.459 ' HB ' ' HB3' ' B' ' 10' ' ' ASP . 99.2 m -57.78 -14.57 6.08 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.221 -0.924 . . . . 0.0 110.368 -179.86 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.597 HD23 HD12 ' B' ' 17' ' ' LEU . 70.4 mt -83.04 -32.22 26.99 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.176 -0.952 . . . . 0.0 110.313 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -59.53 -35.91 75.11 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.156 -0.965 . . . . 0.0 110.065 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.447 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.7 t -70.46 -34.82 72.86 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.198 -0.939 . . . . 0.0 110.108 179.749 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.597 HD12 HD23 ' B' ' 14' ' ' LEU . 13.6 mt -58.84 -50.77 72.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.374 -0.829 . . . . 0.0 110.164 -179.922 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.588 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 33.1 ttt180 -46.29 -30.19 1.95 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.293 -0.88 . . . . 0.0 109.903 179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.473 ' O ' ' HB2' ' B' ' 22' ' ' LYS . 30.0 t80 -65.06 -47.3 77.8 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.405 -0.809 . . . . 0.0 110.319 179.865 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -59.71 -33.9 72.22 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.209 -0.932 . . . . 0.0 110.27 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.588 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.4 m-30 -66.72 -22.87 66.05 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.197 -0.939 . . . . 0.0 110.293 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . 0.473 ' HB2' ' O ' ' B' ' 19' ' ' TYR . 28.7 mmtt -63.37 -30.02 71.22 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.181 -0.95 . . . . 0.0 110.412 -179.845 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 7.0 mmtt -74.92 -48.04 26.69 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.195 -0.941 . . . . 0.0 110.052 -179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.515 ' HB3' ' HB2' ' B' ' 27' ' ' LEU . 15.8 m-70 -94.82 41.63 1.09 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.269 -0.894 . . . . 0.0 110.063 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.566 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 25.2 p -57.04 -18.87 15.84 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.336 -0.853 . . . . 0.0 110.14 -179.94 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.512 HG22 ' O ' ' B' ' 26' ' ' THR . 86.8 m -97.27 6.11 48.9 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.328 -0.858 . . . . 0.0 110.199 179.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.55 HD23 ' HA ' ' B' ' 62' ' ' PHE . 0.7 OUTLIER -92.26 -6.2 50.91 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.224 -0.922 . . . . 0.0 110.324 -179.859 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.566 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 7.6 p90 -143.29 -177.1 5.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.372 -0.83 . . . . 0.0 109.836 -179.604 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.442 HG22 ' N ' ' B' ' 30' ' ' ALA . 1.3 m -94.8 -63.23 1.2 Allowed 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.244 -0.91 . . . . 0.0 109.214 -179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.442 ' N ' HG22 ' B' ' 29' ' ' THR . . . -156.8 143.09 18.17 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 120.985 -1.072 . . . . 0.0 108.625 -179.754 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.594 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.5 p -89.95 110.77 22.29 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.812 0 O-C-N 121.62 -0.675 . . . . 0.0 110.268 -179.627 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.591 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -52.7 145.84 11.39 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.4 -0.812 . . . . 0.0 110.195 179.923 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . 0.54 ' HB2' ' CG2' ' A' ' 38' ' ' THR . 6.8 t -60.66 160.86 8.56 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.284 -0.885 . . . . 0.0 110.102 179.771 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.8 m -67.99 122.73 18.83 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.259 -0.901 . . . . 0.0 110.38 -179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.587 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 26.1 p-90 -147.76 167.02 25.78 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.251 -0.906 . . . . 0.0 109.618 179.796 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.49 ' ND1' ' HB2' ' B' ' 46' ' ' SER . 12.3 t-80 -162.61 -173.66 3.64 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.019 -1.051 . . . . 0.0 110.815 179.665 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.41 ' H ' ' CG ' ' B' ' 36' ' ' HIS . 19.9 m95 -79.43 100.79 7.82 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.535 -0.728 . . . . 0.0 110.379 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.55 ' CG2' ' HB2' ' A' ' 33' ' ' SER . 1.4 t -151.7 142.28 22.68 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.388 -0.82 . . . . 0.0 110.241 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -68.06 -34.2 80.85 Favored Glycine 0 N--CA 1.491 2.318 0 N-CA-C 109.76 -1.336 . . . . 0.0 109.76 -179.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . 0.453 ' CE1' ' HB2' ' B' ' 41' ' ' ASN . 0.0 OUTLIER 179.38 -31.09 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.295 -1.121 . . . . 0.0 109.734 179.887 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . 0.453 ' HB2' ' CE1' ' B' ' 40' ' ' HIS . 7.9 t-20 -174.98 115.18 0.16 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.332 -0.855 . . . . 0.0 109.863 -179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -130.3 -178.82 2.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.243 -0.91 . . . . 0.0 110.197 -179.69 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.475 ' O ' ' C ' ' B' ' 44' ' ' HIS . 26.1 mttt -87.56 -49.69 7.01 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.287 -0.883 . . . . 0.0 110.611 -179.736 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . 0.475 ' C ' ' O ' ' B' ' 43' ' ' LYS . 1.8 m80 -36.07 140.92 0.11 Allowed 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.478 -0.764 . . . . 0.0 110.574 -179.614 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 21.4 mttp -82.28 44.04 0.84 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.351 -0.843 . . . . 0.0 110.579 -179.647 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.49 ' HB2' ' ND1' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -55.97 140.45 43.07 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.179 -0.951 . . . . 0.0 109.811 179.785 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -169.96 117.88 0.58 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.204 -0.935 . . . . 0.0 110.596 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.501 HG23 ' O ' ' B' ' 7' ' ' LEU . 2.5 mt -140.49 155.75 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.319 -0.863 . . . . 0.0 110.338 -179.867 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 62.1 t -138.57 117.89 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.327 -0.858 . . . . 0.0 110.382 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.591 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 93.9 m -93.77 158.49 15.64 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.348 -0.845 . . . . 0.0 110.208 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -136.33 134.42 37.91 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.203 -0.936 . . . . 0.0 109.973 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -96.5 124.63 40.55 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.223 -0.923 . . . . 0.0 110.47 -179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.548 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -104.09 146.79 28.22 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.335 -0.853 . . . . 0.0 109.887 179.716 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -79.17 -8.23 58.84 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.16 -0.963 . . . . 0.0 110.487 -179.422 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 84.3 p -170.71 135.01 1.09 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.203 -0.935 . . . . 0.0 110.252 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.522 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 42.9 mt-10 -51.17 -37.43 46.38 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.288 -0.882 . . . . 0.0 109.965 179.833 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . 0.481 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 35.3 t-105 -53.82 -58.57 6.76 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.124 -0.985 . . . . 0.0 109.81 179.709 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -58.78 -28.54 66.04 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.173 -0.954 . . . . 0.0 110.327 -179.857 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.522 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 54.0 ttp180 -59.47 -48.58 81.09 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.143 -0.973 . . . . 0.0 110.853 -179.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.605 ' HA ' HD21 ' B' ' 63' ' ' LEU . 1.1 p30 -61.04 -33.76 73.79 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.056 -1.027 . . . . 0.0 110.785 -179.19 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.516 ' N ' ' OD1' ' B' ' 60' ' ' ASP . 56.7 mt-30 -65.78 -47.26 75.77 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.062 -1.024 . . . . 0.0 110.122 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.55 ' HA ' HD23 ' B' ' 27' ' ' LEU . 37.2 t80 -55.88 -65.49 0.59 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.455 -0.778 . . . . 0.0 110.646 -179.946 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.605 HD21 ' HA ' ' B' ' 60' ' ' ASP . 2.9 pp -59.13 -18.85 39.47 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.352 -0.842 . . . . 0.0 110.426 -179.589 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.43 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 3.3 t -81.54 -20.32 40.26 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.127 -0.983 . . . . 0.0 110.171 179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 4.3 mm-40 -95.68 -73.5 0.59 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.105 -0.997 . . . . 0.0 110.244 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.51 HG22 ' O ' ' B' ' 62' ' ' PHE . 34.0 m -47.54 130.17 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.212 -0.93 . . . . 0.0 109.937 179.969 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -73.53 108.7 6.53 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.173 -0.954 . . . . 0.0 110.426 -179.77 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . . . . . . . . . 25.1 mt -89.47 121.89 68.86 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.328 -0.858 . . . . 0.0 110.011 179.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.418 ' HG2' HD13 ' B' ' 72' ' ' ILE . 47.1 Cg_endo -57.0 178.55 0.14 Allowed 'Trans proline' 0 C--N 1.305 -1.76 0 O-C-N 123.968 1.509 . . . . 0.0 110.557 -179.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -91.75 -12.34 34.18 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.319 -0.863 . . . . 0.0 110.206 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 11.1 m -84.76 -16.79 40.4 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.212 -0.93 . . . . 0.0 110.283 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.52 ' CD1' ' N ' ' B' ' 72' ' ' ILE . 1.2 mp -93.96 119.14 41.38 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.258 -0.901 . . . . 0.0 110.147 179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 1.3 m -94.43 139.69 30.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.328 -0.857 . . . . 0.0 110.175 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.56 HG22 ' N ' ' B' ' 75' ' ' SER . 8.4 p -90.6 170.69 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.196 -0.94 . . . . 0.0 110.518 -179.383 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . 0.618 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.87 158.53 43.63 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.432 -0.792 . . . . 0.0 111.008 179.823 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 82.8 p -133.34 134.21 43.5 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.453 -0.779 . . . . 0.0 109.97 179.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -168.21 -167.84 29.45 Favored Glycine 0 N--CA 1.492 2.404 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.6 m-85 -147.81 149.45 32.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.1 -1.235 . . . . 0.0 110.507 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.425 ' HE3' HG23 ' B' ' 81' ' ' ILE . 24.1 mmm -125.09 153.18 43.33 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.169 -0.957 . . . . 0.0 110.017 179.851 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.518 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.7 OUTLIER -128.89 104.41 7.59 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.211 -0.931 . . . . 0.0 110.24 -179.988 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.616 HG22 ' OG ' ' A' ' 75' ' ' SER . 13.7 pt . . . . . 0 N--CA 1.491 1.588 0 CA-C-O 117.981 -1.009 . . . . 0.0 110.181 179.876 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 mtm . . . . . 0 N--CA 1.492 1.64 0 CA-C-O 121.171 0.51 . . . . 0.0 110.144 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.446 ' O ' HG23 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -94.72 118.09 66.85 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.175 -0.953 . . . . 0.0 110.15 179.898 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.536 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 50.6 Cg_endo -53.54 147.0 40.37 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 124.093 1.575 . . . . 0.0 110.411 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.446 HG23 ' O ' ' A' ' 2' ' ' THR . 1.1 pt -143.06 109.93 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.34 -0.85 . . . . 0.0 110.024 179.879 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 48.9 t -93.95 153.92 3.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.174 -0.954 . . . . 0.0 110.424 -179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.566 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 0.0 OUTLIER -134.71 117.14 15.7 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.372 -0.83 . . . . 0.0 109.821 179.591 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.55 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.8 OUTLIER -112.74 145.36 40.68 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.27 -0.894 . . . . 0.0 110.087 -179.716 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 72' ' ' ILE . 20.4 tttm -143.42 169.8 16.99 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.274 -0.891 . . . . 0.0 110.265 -179.798 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.79 -157.35 27.24 Favored Glycine 0 N--CA 1.492 2.422 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.481 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 81.9 m-20 -64.79 123.5 19.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.179 -1.189 . . . . 0.0 109.948 179.904 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.806 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.77 -43.94 48.46 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.352 -0.842 . . . . 0.0 110.632 -179.659 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 99.5 m-20 -60.42 -48.22 82.68 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.241 -0.912 . . . . 0.0 110.451 -179.706 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.4 m -57.96 -28.19 64.12 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.301 -0.874 . . . . 0.0 110.419 -179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.806 HD12 ' HA ' ' A' ' 11' ' ' ALA . 97.5 mt -65.69 -30.03 70.66 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.214 -0.929 . . . . 0.0 110.042 179.977 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.1 -36.92 78.49 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.32 -0.862 . . . . 0.0 110.147 179.754 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.548 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 4.6 t -70.06 -40.56 75.01 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.25 -0.907 . . . . 0.0 110.762 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.405 HD11 ' CD1' ' A' ' 72' ' ' ILE . 1.0 OUTLIER -58.75 -52.03 67.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.973 -1.079 . . . . 0.0 110.188 -179.972 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.527 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 7.3 ttt-85 -48.31 -27.6 2.62 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.283 -0.886 . . . . 0.0 110.258 179.618 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.548 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 64.6 t80 -64.65 -25.74 68.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.224 -0.922 . . . . 0.0 110.074 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 87.0 mtt180 -83.55 -25.33 31.07 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.228 -0.92 . . . . 0.0 109.919 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.565 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.2 m-30 -66.5 -22.62 66.18 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.387 -0.821 . . . . 0.0 110.439 -179.98 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 22.6 mmtt -63.32 -47.35 82.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.172 -0.955 . . . . 0.0 110.173 -179.783 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.06 -20.26 59.62 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.189 -0.944 . . . . 0.0 109.839 179.769 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.895 ' HB3' HD12 ' A' ' 27' ' ' LEU . 20.8 m170 -95.42 39.67 1.12 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.3 -0.875 . . . . 0.0 110.161 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.493 ' SG ' ' N ' ' A' ' 26' ' ' THR . 19.3 p -57.06 -36.2 70.24 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.11 -0.994 . . . . 0.0 110.368 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.551 ' O ' HG23 ' A' ' 26' ' ' THR . 8.7 t -97.27 67.04 2.11 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.134 -0.979 . . . . 0.0 110.543 -179.908 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.895 HD12 ' HB3' ' A' ' 24' ' ' HIS . 10.0 mt -148.11 -43.95 0.16 Allowed 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.258 -0.901 . . . . 0.0 110.074 179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 40.4 p90 -107.11 170.25 8.07 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.208 -0.932 . . . . 0.0 109.725 179.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.445 HG23 ' OD2' ' A' ' 54' ' ' ASP . 0.2 OUTLIER -100.34 -33.84 10.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.087 -1.008 . . . . 0.0 111.046 -179.348 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.417 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -159.73 116.82 2.6 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.097 . . . . 0.0 110.924 -179.711 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.46 ' O ' HG13 ' A' ' 31' ' ' VAL . 6.4 p -90.03 131.33 37.55 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.267 -0.896 . . . . 0.0 110.019 179.262 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.582 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 53.8 p -86.02 149.23 25.31 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.251 -0.905 . . . . 0.0 110.302 -179.669 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 8.0 t -61.36 161.58 9.01 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.142 -0.974 . . . . 0.0 110.013 179.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.87 128.37 36.26 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.326 -0.859 . . . . 0.0 110.406 -179.937 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 36.6 p-90 -146.36 -179.25 6.62 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.294 -0.879 . . . . 0.0 109.77 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.57 ' CD2' ' HB2' ' A' ' 46' ' ' SER . 7.5 t-80 -162.56 169.71 19.79 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.1 -1.0 . . . . 0.0 110.208 -179.535 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.565 ' O ' ' CE1' ' A' ' 36' ' ' HIS . 56.4 m95 -79.07 110.01 13.92 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.212 -0.93 . . . . 0.0 110.159 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 11.3 t -75.95 -155.82 0.06 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.274 -0.891 . . . . 0.0 110.183 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.71 147.2 4.67 Favored Glycine 0 N--CA 1.488 2.124 0 N-CA-C 109.35 -1.5 . . . . 0.0 109.35 179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 6.0 t60 -49.43 -30.86 8.67 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.232 -1.157 . . . . 0.0 110.144 -179.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -114.03 136.21 53.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.221 -0.925 . . . . 0.0 110.08 179.793 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -118.06 -168.46 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.177 -0.952 . . . . 0.0 109.883 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 66.6 tttt -149.73 -70.47 0.19 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.149 -0.969 . . . . 0.0 110.453 -179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -147.23 -170.76 3.63 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.241 -0.912 . . . . 0.0 110.308 -179.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 11.8 mttt -74.83 107.92 7.23 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.374 -0.829 . . . . 0.0 109.889 179.725 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.57 ' HB2' ' CD2' ' A' ' 36' ' ' HIS . 0.7 OUTLIER -125.6 26.78 6.65 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.216 -0.927 . . . . 0.0 110.356 -179.775 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.502 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . -35.99 145.69 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.493 -0.754 . . . . 0.0 110.516 -179.869 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.55 HG23 ' O ' ' A' ' 7' ' ' LEU . 10.0 mt -142.48 157.71 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.226 -0.921 . . . . 0.0 109.915 -179.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.522 HG13 ' N ' ' A' ' 50' ' ' THR . 0.4 OUTLIER -139.0 179.51 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.154 -0.966 . . . . 0.0 110.521 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.566 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 49.2 m -145.65 153.77 41.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.391 -0.818 . . . . 0.0 109.571 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.91 128.79 35.28 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.034 -1.042 . . . . 0.0 110.342 -179.688 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 5.1 m -96.98 127.13 42.64 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.368 -0.833 . . . . 0.0 110.168 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.536 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 53.8 m-85 -106.85 147.79 29.32 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.31 -0.869 . . . . 0.0 110.064 179.774 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.445 ' OD2' HG23 ' A' ' 29' ' ' THR . 0.3 OUTLIER -71.44 -6.02 37.2 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.346 -0.847 . . . . 0.0 110.773 -179.602 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 p -175.84 174.51 2.15 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.101 -1.0 . . . . 0.0 110.594 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -74.98 -44.98 45.18 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.317 -0.865 . . . . 0.0 110.353 -179.87 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.505 ' O ' ' OD2' ' A' ' 60' ' ' ASP . 67.0 t-105 -53.62 -50.09 66.44 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.175 -0.953 . . . . 0.0 109.916 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.528 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 53.9 tt0 -57.08 -39.56 75.21 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.233 -0.917 . . . . 0.0 110.586 -179.411 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.488 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 6.4 ttp180 -59.26 -40.67 86.75 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.98 -1.075 . . . . 0.0 110.643 179.902 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.505 ' OD2' ' O ' ' A' ' 57' ' ' TRP . 0.0 OUTLIER -61.45 -39.61 91.48 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.096 -1.003 . . . . 0.0 110.749 -179.429 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.478 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 23.1 mt-30 -65.4 -44.12 88.48 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.226 -0.921 . . . . 0.0 110.481 -179.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.754 ' O ' HG22 ' A' ' 66' ' ' VAL . 86.2 t80 -55.3 -42.01 73.09 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.179 -0.951 . . . . 0.0 110.119 -179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.5 mt -59.61 -13.24 8.68 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.269 -0.894 . . . . 0.0 110.221 179.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 15.7 p -98.83 -14.87 19.47 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.194 -0.941 . . . . 0.0 110.423 -179.762 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.478 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 4.5 mm-40 -96.48 -12.65 23.87 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.173 -0.954 . . . . 0.0 109.992 179.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.754 HG22 ' O ' ' A' ' 62' ' ' PHE . 13.8 m -133.22 105.21 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.525 0 O-C-N 121.302 -0.874 . . . . 0.0 110.084 -179.991 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -62.37 123.66 18.84 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.274 -0.891 . . . . 0.0 110.398 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.43 ' HA ' HD13 ' A' ' 68' ' ' ILE . 25.3 mm -88.95 113.45 56.1 Favored Pre-proline 0 N--CA 1.491 1.596 0 O-C-N 121.293 -0.88 . . . . 0.0 110.266 179.846 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.462 ' HG2' ' CG1' ' A' ' 72' ' ' ILE . 44.3 Cg_endo -56.61 152.33 41.72 Favored 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.042 1.548 . . . . 0.0 110.499 -179.966 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 24.9 mtpp -68.75 -11.85 60.79 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.275 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 11.2 m -84.64 -24.89 28.87 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.198 -0.939 . . . . 0.0 109.974 179.875 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.471 HG23 ' O ' ' A' ' 8' ' ' LYS . 12.3 mt -94.12 123.45 46.23 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.466 -0.771 . . . . 0.0 110.148 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 92.4 m -94.48 138.0 32.92 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.23 -0.919 . . . . 0.0 110.023 179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.0 t -91.26 172.59 0.97 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.204 -0.935 . . . . 0.0 110.574 -179.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.549 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.89 155.41 44.74 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.566 -0.708 . . . . 0.0 110.381 179.524 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.482 ' O ' ' HB3' ' B' ' 80' ' ' SER . 0.6 OUTLIER -133.19 136.13 45.48 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.221 -0.924 . . . . 0.0 110.186 179.26 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.41 ' O ' HG13 ' A' ' 4' ' ' ILE . . . -176.39 -172.33 40.98 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.101 -1.6 . . . . 0.0 109.101 -179.956 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.446 ' HA ' HG12 ' A' ' 4' ' ' ILE . 97.7 m-85 -148.14 155.18 41.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.09 -1.241 . . . . 0.0 110.64 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' B' ' 79' ' ' MET . 27.2 mtt -123.64 174.79 7.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.333 -0.855 . . . . 0.0 110.168 179.925 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.488 ' C ' ' CG1' ' A' ' 81' ' ' ILE . 0.0 OUTLIER -139.08 109.19 6.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.233 -0.917 . . . . 0.0 110.085 179.975 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.488 ' CG1' ' C ' ' A' ' 80' ' ' SER . 10.8 mt . . . . . 0 N--CA 1.491 1.582 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.173 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 14.1 mtm . . . . . 0 N--CA 1.491 1.587 0 CA-C-O 121.276 0.56 . . . . 0.0 110.317 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.43 ' O ' HG23 ' B' ' 4' ' ' ILE . 0.0 OUTLIER -94.07 118.07 67.19 Favored Pre-proline 0 N--CA 1.492 1.639 0 O-C-N 121.319 -0.863 . . . . 0.0 110.078 179.927 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 49.8 Cg_endo -53.9 147.61 41.42 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.942 1.496 . . . . 0.0 110.496 -179.853 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.434 HG12 ' CA ' ' B' ' 78' ' ' PHE . 1.1 pt -142.95 109.52 1.62 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.39 -0.819 . . . . 0.0 109.984 179.785 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -93.8 153.13 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.602 0 O-C-N 121.306 -0.871 . . . . 0.0 110.271 -179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.536 ' HB2' ' HB3' ' B' ' 75' ' ' SER . 0.0 OUTLIER -134.13 117.17 16.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.332 -0.855 . . . . 0.0 109.952 179.835 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.565 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.8 OUTLIER -112.87 145.5 40.58 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.178 -0.951 . . . . 0.0 110.33 -179.785 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.468 ' O ' HG23 ' B' ' 72' ' ' ILE . 19.9 tttm -143.46 169.76 17.07 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.388 -0.82 . . . . 0.0 110.294 -179.963 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 148.71 -157.38 27.26 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.53 -1.428 . . . . 0.0 109.53 179.89 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 81.8 m-20 -64.57 123.1 18.38 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.18 -1.188 . . . . 0.0 110.041 179.936 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.807 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.9 -43.24 49.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.297 -0.877 . . . . 0.0 110.571 -179.763 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 99.6 m-20 -60.48 -48.33 82.22 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.194 -0.941 . . . . 0.0 110.358 -179.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 5.9 m -58.31 -28.42 65.01 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.339 -0.851 . . . . 0.0 110.452 -179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.807 HD12 ' HA ' ' B' ' 11' ' ' ALA . 94.3 mt -65.75 -30.0 70.59 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.251 -0.905 . . . . 0.0 110.145 179.988 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -60.12 -36.96 78.62 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.3 -0.875 . . . . 0.0 110.19 179.759 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.547 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 4.7 t -70.0 -40.55 75.22 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.271 -0.893 . . . . 0.0 110.64 -179.631 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.41 HD11 ' CD1' ' B' ' 72' ' ' ILE . 1.0 OUTLIER -58.83 -51.81 68.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.014 -1.054 . . . . 0.0 110.252 -179.764 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.521 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 7.3 ttt-85 -48.29 -27.4 2.48 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.345 -0.847 . . . . 0.0 110.37 179.622 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.547 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 65.4 t80 -64.6 -26.33 68.35 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.277 -0.889 . . . . 0.0 110.15 -179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 88.4 mtt180 -82.89 -25.27 32.65 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.235 -0.915 . . . . 0.0 109.943 179.657 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.575 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.3 m-30 -66.46 -23.04 66.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.359 -0.838 . . . . 0.0 110.425 179.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 23.5 mmtt -63.21 -47.01 84.35 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.25 -0.906 . . . . 0.0 110.304 -179.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.8 mmtm -75.11 -20.71 59.31 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.179 -0.951 . . . . 0.0 109.859 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.899 ' HB3' HD12 ' B' ' 27' ' ' LEU . 20.7 m170 -95.11 40.01 1.11 Allowed 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.462 -0.773 . . . . 0.0 110.072 179.955 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.496 ' SG ' ' N ' ' B' ' 26' ' ' THR . 18.5 p -57.3 -36.49 71.13 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.243 -0.91 . . . . 0.0 110.354 -179.811 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.527 HG23 ' O ' ' B' ' 26' ' ' THR . 7.0 t -97.21 67.05 2.13 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.149 -0.969 . . . . 0.0 110.582 -179.849 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.899 HD12 ' HB3' ' B' ' 24' ' ' HIS . 10.1 mt -148.16 -44.38 0.16 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.204 -0.935 . . . . 0.0 110.049 179.733 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 39.8 p90 -106.49 170.31 8.0 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.204 -0.935 . . . . 0.0 109.763 179.427 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.444 HG23 ' OD2' ' B' ' 54' ' ' ASP . 0.2 OUTLIER -100.26 -33.95 10.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.021 -1.05 . . . . 0.0 111.005 -179.314 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.401 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -159.67 116.91 2.63 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.991 -1.068 . . . . 0.0 110.866 -179.718 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.479 ' O ' HG13 ' B' ' 31' ' ' VAL . 6.9 p -90.11 130.1 39.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.262 -0.899 . . . . 0.0 109.935 179.333 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.58 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 57.6 p -84.58 149.37 25.92 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.223 -0.923 . . . . 0.0 110.295 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 8.2 t -61.45 162.22 8.34 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.088 -1.008 . . . . 0.0 110.219 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 1.4 m -67.98 127.85 34.36 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.266 -0.896 . . . . 0.0 110.269 179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.582 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 37.9 p-90 -146.14 -178.92 6.38 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.22 -0.925 . . . . 0.0 109.882 179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.576 ' CE1' ' O ' ' B' ' 37' ' ' TRP . 7.9 t-80 -162.56 169.38 20.33 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.054 -1.029 . . . . 0.0 110.414 -179.503 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.576 ' O ' ' CE1' ' B' ' 36' ' ' HIS . 58.1 m95 -79.07 110.15 14.04 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.24 -0.913 . . . . 0.0 109.903 179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 9.9 t -76.03 -155.69 0.06 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.29 -0.881 . . . . 0.0 110.225 -179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 143.84 145.79 4.43 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -48.19 -31.79 6.21 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.125 -1.221 . . . . 0.0 110.024 179.863 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -113.44 135.56 53.75 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.307 -0.87 . . . . 0.0 110.198 -179.961 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -117.65 -168.88 0.46 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.188 -0.945 . . . . 0.0 109.927 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 66.5 tttt -149.39 -70.37 0.2 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.202 -0.936 . . . . 0.0 110.451 -179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 1.2 m-70 -147.29 -172.05 3.93 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.157 -0.964 . . . . 0.0 110.352 -179.799 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 10.9 mttt -73.71 106.98 5.7 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.312 -0.868 . . . . 0.0 110.0 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.532 ' HB2' ' CD2' ' B' ' 36' ' ' HIS . 0.7 OUTLIER -124.97 27.55 6.69 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.195 -0.941 . . . . 0.0 110.492 -179.781 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.503 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . . . -36.74 145.87 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.447 -0.783 . . . . 0.0 110.621 -179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.565 HG23 ' O ' ' B' ' 7' ' ' LEU . 9.2 mt -142.65 157.95 18.73 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.345 -0.847 . . . . 0.0 109.963 -179.707 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.532 HG13 ' N ' ' B' ' 50' ' ' THR . 0.4 OUTLIER -139.14 179.95 2.71 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.123 -0.985 . . . . 0.0 110.637 -179.751 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.532 ' N ' HG13 ' B' ' 49' ' ' VAL . 54.5 m -145.9 153.07 40.44 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 109.811 179.847 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -133.3 128.84 36.63 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.166 -0.959 . . . . 0.0 110.464 -179.76 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 4.7 m -97.12 126.92 42.62 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.371 -0.83 . . . . 0.0 110.246 -179.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.522 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 56.6 m-85 -106.87 148.17 28.88 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.258 -0.901 . . . . 0.0 110.013 179.773 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.444 ' OD2' HG23 ' B' ' 29' ' ' THR . 0.3 OUTLIER -72.15 -6.41 42.46 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.318 -0.864 . . . . 0.0 110.805 -179.338 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 p -174.81 174.89 2.5 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.064 -1.023 . . . . 0.0 110.264 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.4 mt-10 -75.91 -44.14 41.75 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.26 -0.9 . . . . 0.0 110.109 -179.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . 0.485 ' O ' ' OD2' ' B' ' 60' ' ' ASP . 67.0 t-105 -53.64 -49.95 66.8 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.29 -0.881 . . . . 0.0 110.197 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.538 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.0 tt0 -57.3 -39.39 75.65 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.22 -0.925 . . . . 0.0 110.645 -179.299 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.467 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 6.3 ttp180 -59.29 -41.35 88.75 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.138 -0.976 . . . . 0.0 110.714 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.485 ' OD2' ' O ' ' B' ' 57' ' ' TRP . 0.0 OUTLIER -61.19 -39.18 89.22 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.124 -0.985 . . . . 0.0 110.741 -179.386 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.467 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 23.3 mt-30 -65.42 -44.24 87.97 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.089 -1.007 . . . . 0.0 110.437 -179.495 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.745 ' O ' HG22 ' B' ' 66' ' ' VAL . 83.7 t80 -55.28 -41.8 72.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.137 -0.977 . . . . 0.0 109.935 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.0 mt -59.68 -12.56 7.18 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.246 -0.909 . . . . 0.0 110.176 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 12.3 p -99.5 -14.79 18.91 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.228 -0.92 . . . . 0.0 110.488 179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . 0.467 ' HG2' ' O ' ' B' ' 61' ' ' GLN . 4.5 mm-40 -96.45 -12.68 23.89 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.135 -0.978 . . . . 0.0 110.113 179.865 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.745 HG22 ' O ' ' B' ' 62' ' ' PHE . 13.1 m -133.26 104.65 6.91 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.351 -0.843 . . . . 0.0 110.171 -179.903 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.6 tptp -62.0 123.86 19.22 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.428 -179.789 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.421 ' HA ' HD13 ' B' ' 68' ' ' ILE . 25.3 mm -88.95 113.42 55.98 Favored Pre-proline 0 N--CA 1.492 1.659 0 O-C-N 121.288 -0.883 . . . . 0.0 110.298 179.864 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.473 ' HG2' ' CG1' ' B' ' 72' ' ' ILE . 45.0 Cg_endo -56.4 152.6 38.73 Favored 'Trans proline' 0 C--N 1.306 -1.702 0 O-C-N 123.957 1.504 . . . . 0.0 110.423 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 25.0 mtpp -69.29 -11.86 61.17 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.219 -0.926 . . . . 0.0 110.29 -179.919 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 10.7 m -84.48 -24.63 29.35 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.252 -0.905 . . . . 0.0 109.882 179.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.473 ' CG1' ' HG2' ' B' ' 69' ' ' PRO . 12.2 mt -94.37 123.41 46.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.275 -0.89 . . . . 0.0 110.267 179.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 99.1 m -94.53 138.07 32.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.194 -0.941 . . . . 0.0 110.163 -179.999 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.424 ' H ' HG23 ' B' ' 74' ' ' VAL . 1.7 t -91.32 172.49 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.223 -0.923 . . . . 0.0 110.517 -179.413 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . 0.536 ' HB3' ' HB2' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -143.09 155.65 44.65 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.517 -0.74 . . . . 0.0 110.346 179.483 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . 0.458 ' O ' ' HB3' ' A' ' 80' ' ' SER . 0.6 OUTLIER -133.41 135.63 44.74 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.18 -0.95 . . . . 0.0 110.203 179.361 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.405 ' O ' HG13 ' B' ' 4' ' ' ILE . . . -175.35 -172.21 40.03 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.094 -1.602 . . . . 0.0 109.094 -179.915 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.434 ' CA ' HG12 ' B' ' 4' ' ' ILE . 97.7 m-85 -147.98 155.12 41.18 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.109 -1.23 . . . . 0.0 110.524 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.522 ' CE ' ' CE ' ' A' ' 79' ' ' MET . 27.4 mtt -123.98 173.75 8.04 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.405 -0.809 . . . . 0.0 110.052 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.487 ' C ' ' CG1' ' B' ' 81' ' ' ILE . 0.0 OUTLIER -138.23 109.14 6.71 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.233 -0.917 . . . . 0.0 110.19 -179.995 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.487 ' CG1' ' C ' ' B' ' 80' ' ' SER . 10.4 mt . . . . . 0 N--CA 1.493 1.707 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.108 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' A' ' 2' ' ' THR . 70.1 mtm . . . . . 0 N--CA 1.491 1.591 0 CA-C-O 121.213 0.53 . . . . 0.0 110.176 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' A' ' 1' ' ' MET . 76.7 m -43.71 105.23 0.42 Allowed Pre-proline 0 N--CA 1.491 1.59 0 O-C-N 121.289 -0.882 . . . . 0.0 110.135 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 46.5 Cg_endo -56.42 157.65 17.77 Favored 'Trans proline' 0 C--N 1.304 -1.765 0 O-C-N 124.15 1.605 . . . . 0.0 110.743 -179.731 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.541 HG22 HG22 ' A' ' 52' ' ' THR . 2.5 pp -144.09 168.28 11.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.37 -0.832 . . . . 0.0 109.947 179.915 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.521 ' O ' HG13 ' A' ' 5' ' ' VAL . 8.8 p -146.11 129.82 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.181 -0.949 . . . . 0.0 110.544 -179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.564 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 2.7 m170 -106.35 122.94 47.26 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.203 -0.936 . . . . 0.0 110.072 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.811 ' O ' HG23 ' A' ' 48' ' ' ILE . 11.8 mt -114.36 146.87 40.01 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.179 -0.951 . . . . 0.0 110.127 179.919 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.511 ' HB2' HG12 ' A' ' 48' ' ' ILE . 31.9 ttpt -141.43 165.58 27.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.186 -0.946 . . . . 0.0 110.721 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.42 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 154.28 -168.11 32.5 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.318 -1.513 . . . . 0.0 109.318 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.454 ' O ' ' HB ' ' A' ' 13' ' ' THR . 9.3 m-20 -64.71 142.27 58.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.183 -1.187 . . . . 0.0 109.921 179.873 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.64 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.89 -68.5 0.17 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.222 -0.924 . . . . 0.0 110.282 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -44.27 -43.56 7.42 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.3 -0.875 . . . . 0.0 110.245 -179.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.592 ' CG2' HD11 ' A' ' 72' ' ' ILE . 7.0 m -58.11 -28.52 64.71 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.161 -0.962 . . . . 0.0 110.309 -179.928 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.64 HD12 ' HA ' ' A' ' 11' ' ' ALA . 17.6 mt -77.17 -29.8 54.62 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.272 -0.892 . . . . 0.0 110.164 179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.413 ' HB2' ' HE3' ' A' ' 15' ' ' LYS . 13.5 ttmt -60.01 -34.59 73.56 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.288 -0.882 . . . . 0.0 110.054 179.807 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 12.3 t -70.13 -37.08 75.21 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.355 -0.841 . . . . 0.0 110.664 -179.748 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.443 HD11 HG12 ' A' ' 72' ' ' ILE . 20.7 mt -58.98 -48.17 82.52 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.137 -0.977 . . . . 0.0 110.45 -179.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 19.3 ttp180 -47.33 -33.46 5.76 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.313 -0.867 . . . . 0.0 110.397 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.541 ' CD1' ' C ' ' A' ' 19' ' ' TYR . 4.2 t80 -64.59 -38.44 91.0 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.29 -0.882 . . . . 0.0 110.305 -179.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -69.46 -33.16 72.51 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.18 -0.95 . . . . 0.0 110.213 -179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.536 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.48 -31.74 72.66 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.191 -0.943 . . . . 0.0 110.276 -179.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.46 -16.54 60.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.227 -0.921 . . . . 0.0 110.148 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtm -75.02 -41.0 60.18 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.252 -0.905 . . . . 0.0 109.651 179.586 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.967 ' CG ' HD12 ' A' ' 27' ' ' LEU . 5.0 m-70 -95.08 75.97 3.49 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.305 -0.872 . . . . 0.0 109.559 179.472 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 19.3 p -58.18 -6.45 0.63 Allowed 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.484 -0.76 . . . . 0.0 111.933 -179.233 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.82 31.98 1.62 Allowed 'General case' 0 N--CA 1.494 1.741 0 O-C-N 120.584 -1.322 . . . . 0.0 111.1 -179.403 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.967 HD12 ' CG ' ' A' ' 24' ' ' HIS . 2.1 mt -93.1 -35.46 13.19 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.045 -1.034 . . . . 0.0 110.437 179.396 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -107.94 169.68 8.46 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.17 -0.957 . . . . 0.0 110.318 -179.683 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.517 ' OG1' ' N ' ' A' ' 54' ' ' ASP . 36.3 m -100.2 -34.36 10.06 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.286 -0.884 . . . . 0.0 111.131 -179.589 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.51 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.75 117.72 2.7 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.977 -1.077 . . . . 0.0 110.72 -179.832 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.595 ' O ' HG13 ' A' ' 31' ' ' VAL . 4.9 p -90.69 105.64 16.59 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.586 0 O-C-N 121.127 -0.983 . . . . 0.0 109.9 179.085 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.465 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 1.4 p -68.58 155.06 40.7 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.142 -0.974 . . . . 0.0 110.404 -179.902 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 14.6 p -61.37 163.83 6.22 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 109.992 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -67.99 125.58 26.77 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.222 -0.924 . . . . 0.0 110.471 -179.766 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.527 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 25.9 p-90 -146.11 173.34 12.28 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.079 -1.013 . . . . 0.0 109.738 179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.527 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 11.0 p80 -162.61 -175.38 4.44 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.084 -1.01 . . . . 0.0 110.805 -179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 68.3 m95 -79.31 155.03 28.66 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.278 -0.889 . . . . 0.0 110.105 179.836 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -142.99 -165.14 2.0 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 121.236 -0.915 . . . . 0.0 110.213 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 127.13 -120.79 3.69 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.498 -1.441 . . . . 0.0 109.498 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 45.0 m80 -47.04 -24.13 0.59 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.264 -1.139 . . . . 0.0 110.399 179.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.427 ' OD1' ' HG3' ' A' ' 45' ' ' LYS . 10.9 t-20 -135.68 76.25 1.6 Allowed 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.265 -0.897 . . . . 0.0 110.38 -179.787 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.4 m -53.99 -23.58 9.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.169 -0.957 . . . . 0.0 109.864 179.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 7.4 mttp -59.29 167.98 1.63 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -0.858 . . . . 0.0 109.943 179.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -45.89 112.35 0.46 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.24 -0.913 . . . . 0.0 109.996 179.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.427 ' HG3' ' OD1' ' A' ' 41' ' ' ASN . 0.0 OUTLIER -111.49 -57.86 2.19 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.212 -0.93 . . . . 0.0 110.22 -179.882 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.515 ' O ' ' HB3' ' A' ' 36' ' ' HIS . 3.5 m -145.17 67.96 1.23 Allowed 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.22 -0.925 . . . . 0.0 110.407 179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.491 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . -45.01 129.2 7.44 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.171 -0.956 . . . . 0.0 109.78 179.754 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.811 HG23 ' O ' ' A' ' 7' ' ' LEU . 43.6 mt -142.69 141.9 27.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.555 0 O-C-N 121.118 -0.989 . . . . 0.0 110.601 -179.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 t -111.63 117.32 54.83 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.414 -0.804 . . . . 0.0 109.958 179.706 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.58 ' C ' HD12 ' A' ' 51' ' ' LEU . 50.3 m -93.69 146.58 23.73 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.181 -0.949 . . . . 0.0 110.008 -179.918 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.58 HD12 ' C ' ' A' ' 50' ' ' THR . 5.4 mp -135.62 129.73 33.3 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.128 -0.983 . . . . 0.0 110.273 -179.978 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.541 HG22 HG22 ' A' ' 4' ' ' ILE . 0.6 OUTLIER -97.95 136.4 38.28 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.548 -0.72 . . . . 0.0 110.114 179.72 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.522 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 89.9 m-85 -110.42 150.6 28.59 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.341 -0.85 . . . . 0.0 109.865 179.757 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.517 ' N ' ' OG1' ' A' ' 29' ' ' THR . 1.8 t0 -84.52 -10.06 57.78 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.138 -0.976 . . . . 0.0 110.458 -179.495 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.51 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 0.4 OUTLIER -149.06 150.83 33.43 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.118 -0.989 . . . . 0.0 110.314 -179.749 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 19.3 mt-10 -67.96 -56.21 9.86 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.241 -0.912 . . . . 0.0 110.139 179.99 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.523 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 12.3 p90 -53.95 -36.81 63.23 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.195 -0.941 . . . . 0.0 110.003 179.894 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.523 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 64.7 tt0 -58.32 -49.22 77.97 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.262 -0.899 . . . . 0.0 110.22 -179.841 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.4 ttp180 -58.71 -36.27 73.99 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.264 -0.897 . . . . 0.0 110.112 179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.661 ' HA ' HD21 ' A' ' 63' ' ' LEU . 18.8 m-20 -61.42 -42.24 98.43 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.28 -0.888 . . . . 0.0 110.528 -179.949 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.49 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 62.1 mt-30 -65.92 -37.32 85.77 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.06 -1.025 . . . . 0.0 110.308 -179.91 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.547 ' CD1' ' N ' ' A' ' 63' ' ' LEU . 10.5 t80 -55.41 -63.75 1.06 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.204 -0.935 . . . . 0.0 110.276 -179.867 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.661 HD21 ' HA ' ' A' ' 60' ' ' ASP . 3.2 pp -59.79 -17.1 33.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.251 -0.906 . . . . 0.0 110.585 -179.685 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.443 ' HB3' ' O ' ' A' ' 60' ' ' ASP . 0.9 OUTLIER -83.87 -20.81 32.46 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.184 -0.948 . . . . 0.0 110.434 -179.881 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.49 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 41.5 mt-30 -95.53 -61.92 1.38 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.166 -0.959 . . . . 0.0 110.17 -179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.486 ' H ' HG22 ' A' ' 66' ' ' VAL . 15.7 m -79.63 70.19 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.156 -0.965 . . . . 0.0 109.876 179.784 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 4.1 tptm -44.85 117.98 1.49 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.551 -179.781 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.496 HG12 ' HB ' ' A' ' 72' ' ' ILE . 0.9 OUTLIER -88.61 134.31 34.34 Favored Pre-proline 0 N--CA 1.486 1.363 0 O-C-N 121.244 -0.91 . . . . 0.0 110.141 -179.929 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.439 ' HG2' HD13 ' A' ' 72' ' ' ILE . 47.0 Cg_endo -55.25 176.52 0.14 Allowed 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 123.875 1.46 . . . . 0.0 110.66 -179.805 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 10.3 tptt -81.94 3.24 27.14 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.308 -0.87 . . . . 0.0 110.436 -179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -84.29 -33.19 24.02 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.22 -0.925 . . . . 0.0 109.795 179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.592 HD11 ' CG2' ' A' ' 13' ' ' THR . 2.0 mp -93.92 123.21 45.94 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 121.412 -0.805 . . . . 0.0 109.903 179.631 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 32.6 m -94.61 138.17 32.81 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.921 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.46 HG22 ' N ' ' A' ' 75' ' ' SER . 7.7 p -90.86 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 O-C-N 121.256 -0.902 . . . . 0.0 111.171 -178.887 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.564 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -143.69 157.57 44.3 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.736 -0.603 . . . . 0.0 110.058 179.306 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.9 p -133.13 133.12 42.48 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.187 -0.946 . . . . 0.0 110.172 179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.7 -165.69 15.76 Favored Glycine 0 N--CA 1.489 2.2 0 N-CA-C 109.289 -1.524 . . . . 0.0 109.289 -179.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' B' ' 78' ' ' PHE . 55.9 m-85 -147.88 153.63 39.36 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.185 -1.185 . . . . 0.0 110.356 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 93.5 mmm -139.26 152.78 47.56 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.219 -0.926 . . . . 0.0 110.2 -179.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 28.5 t -134.96 100.57 4.62 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.229 -0.919 . . . . 0.0 110.376 179.977 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 24.9 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.841 -1.076 . . . . 0.0 110.254 179.796 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.402 ' O ' ' C ' ' B' ' 2' ' ' THR . 69.6 mtm . . . . . 0 N--CA 1.49 1.545 0 CA-C-O 121.236 0.541 . . . . 0.0 110.106 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.402 ' C ' ' O ' ' B' ' 1' ' ' MET . 54.7 m -43.79 104.25 0.37 Allowed Pre-proline 0 N--CA 1.49 1.572 0 O-C-N 121.324 -0.86 . . . . 0.0 110.169 -179.895 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.53 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.1 Cg_endo -55.38 157.73 14.04 Favored 'Trans proline' 0 C--N 1.304 -1.777 0 O-C-N 124.14 1.6 . . . . 0.0 110.746 -179.707 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.525 HG22 HG22 ' B' ' 52' ' ' THR . 2.6 pp -144.23 168.55 10.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.706 0 O-C-N 121.297 -0.877 . . . . 0.0 110.068 179.813 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.523 ' O ' HG13 ' B' ' 5' ' ' VAL . 9.4 p -146.45 129.76 9.43 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.154 -0.966 . . . . 0.0 110.552 -179.739 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.572 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 2.9 m170 -106.52 123.34 47.95 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.268 -0.895 . . . . 0.0 110.152 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.805 ' O ' HG23 ' B' ' 48' ' ' ILE . 12.1 mt -114.47 146.61 40.45 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.112 -0.992 . . . . 0.0 110.163 -179.965 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.513 ' HB2' HG12 ' B' ' 48' ' ' ILE . 31.7 ttpt -141.48 165.42 27.54 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.08 -1.013 . . . . 0.0 110.723 -179.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.425 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 154.44 -167.96 32.56 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.27 -1.532 . . . . 0.0 109.27 -179.989 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . 0.438 ' O ' ' HB ' ' B' ' 13' ' ' THR . 8.8 m-20 -64.77 142.84 58.29 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.272 -1.134 . . . . 0.0 109.99 179.889 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.643 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.89 -68.72 0.15 Allowed 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.231 -0.918 . . . . 0.0 110.529 -179.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -44.43 -43.61 7.86 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.249 -0.907 . . . . 0.0 110.358 -179.827 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.601 ' CG2' HD11 ' B' ' 72' ' ' ILE . 6.3 m -57.83 -28.74 64.36 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.279 -0.888 . . . . 0.0 110.164 -179.975 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.643 HD12 ' HA ' ' B' ' 11' ' ' ALA . 19.9 mt -76.53 -30.31 57.08 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.858 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . 0.4 ' HB2' ' HE3' ' B' ' 15' ' ' LYS . 12.5 ttmt -59.96 -35.11 74.27 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.333 -0.855 . . . . 0.0 110.156 179.838 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.495 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 12.0 t -69.87 -36.75 75.74 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.202 -0.937 . . . . 0.0 110.425 -179.732 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.44 HD11 HG12 ' B' ' 72' ' ' ILE . 19.0 mt -58.81 -48.62 80.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.092 -1.005 . . . . 0.0 110.541 -179.828 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 19.0 ttp180 -47.5 -32.78 5.56 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.17 -0.956 . . . . 0.0 110.349 -179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.536 ' CD1' ' C ' ' B' ' 19' ' ' TYR . 4.6 t80 -64.76 -38.12 89.9 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.178 -0.951 . . . . 0.0 110.329 -179.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtt180 -69.91 -33.4 72.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.201 -0.937 . . . . 0.0 110.264 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.54 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.34 -31.42 72.19 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.263 -0.898 . . . . 0.0 110.375 -179.847 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.9 mmtp -63.39 -16.83 61.66 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.204 -0.935 . . . . 0.0 110.254 179.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.2 mmtm -74.89 -41.17 60.27 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.193 -0.942 . . . . 0.0 109.75 179.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.971 ' CG ' HD12 ' B' ' 27' ' ' LEU . 5.1 m-70 -94.89 76.11 3.59 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.263 -0.898 . . . . 0.0 109.368 179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 18.2 p -58.03 -6.84 0.65 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.441 -0.787 . . . . 0.0 112.088 -179.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -141.67 31.88 1.65 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.589 -1.319 . . . . 0.0 111.099 -179.338 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.971 HD12 ' CG ' ' B' ' 24' ' ' HIS . 2.0 mt -93.02 -34.95 13.51 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.057 -1.027 . . . . 0.0 110.355 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -108.04 169.96 8.3 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.293 -179.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.524 ' OG1' ' N ' ' B' ' 54' ' ' ASP . 40.1 m -100.32 -34.82 9.83 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.28 -0.888 . . . . 0.0 111.077 -179.607 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.484 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.83 118.21 2.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.965 -1.085 . . . . 0.0 110.643 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.587 ' O ' HG13 ' B' ' 31' ' ' VAL . 5.4 p -90.82 105.17 16.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.116 -0.99 . . . . 0.0 110.055 179.186 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.488 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 1.7 p -68.22 154.76 41.08 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.146 -0.972 . . . . 0.0 110.292 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 12.9 p -61.36 164.64 5.36 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.173 -0.954 . . . . 0.0 110.153 179.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 8.9 m -68.13 124.93 24.79 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.292 -0.88 . . . . 0.0 110.675 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.54 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 25.1 p-90 -145.57 173.5 11.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.026 -1.046 . . . . 0.0 109.789 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.54 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 10.4 p80 -162.69 -175.06 4.24 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.055 -1.028 . . . . 0.0 110.614 -179.601 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 67.1 m95 -79.8 155.66 27.77 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.333 -0.854 . . . . 0.0 110.063 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -143.64 -164.28 1.84 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.13 -0.981 . . . . 0.0 110.23 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . 126.22 -117.8 2.94 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.629 -1.389 . . . . 0.0 109.629 179.957 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 46.4 m80 -50.22 -24.77 3.06 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.303 -1.116 . . . . 0.0 110.316 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . 0.438 ' OD1' ' HG3' ' B' ' 45' ' ' LYS . 11.5 t-20 -134.6 74.87 1.55 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.169 -0.957 . . . . 0.0 110.357 -179.791 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 35.3 m -52.27 -23.7 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 O-C-N 121.265 -0.897 . . . . 0.0 110.011 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.417 ' O ' ' C ' ' B' ' 44' ' ' HIS . 7.4 mttp -59.78 166.86 2.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.286 -0.884 . . . . 0.0 110.152 179.911 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . 0.417 ' C ' ' O ' ' B' ' 43' ' ' LYS . 0.8 OUTLIER -44.31 111.96 0.36 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.176 -0.953 . . . . 0.0 109.905 179.807 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . 0.438 ' HG3' ' OD1' ' B' ' 41' ' ' ASN . 0.0 OUTLIER -111.65 -56.96 2.32 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.192 -0.942 . . . . 0.0 110.425 -179.802 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.518 ' O ' ' HB3' ' B' ' 36' ' ' HIS . 3.5 m -145.92 67.71 1.2 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.197 -0.939 . . . . 0.0 110.194 -179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.507 ' HA ' ' HB3' ' B' ' 36' ' ' HIS . . . -45.06 129.24 7.57 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.268 -0.895 . . . . 0.0 109.891 179.823 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.805 HG23 ' O ' ' B' ' 7' ' ' LEU . 45.1 mt -142.66 142.34 26.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.169 -0.957 . . . . 0.0 110.645 -179.682 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 4.4 t -112.01 117.06 54.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.503 0 O-C-N 121.443 -0.786 . . . . 0.0 109.716 179.523 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.577 ' C ' HD12 ' B' ' 51' ' ' LEU . 54.5 m -93.15 147.4 22.91 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.251 -0.906 . . . . 0.0 109.916 -179.815 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.577 HD12 ' C ' ' B' ' 50' ' ' THR . 5.3 mp -136.28 129.77 31.98 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.187 -0.945 . . . . 0.0 110.317 -179.786 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.525 HG22 HG22 ' B' ' 4' ' ' ILE . 0.6 OUTLIER -98.14 136.24 38.65 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.469 -0.77 . . . . 0.0 110.068 179.804 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.53 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 89.1 m-85 -110.56 150.74 28.51 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.294 -0.879 . . . . 0.0 109.839 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.524 ' N ' ' OG1' ' B' ' 29' ' ' THR . 1.4 t0 -84.7 -10.16 57.55 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.133 -0.979 . . . . 0.0 110.516 -179.455 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . 0.534 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 0.4 OUTLIER -148.49 151.51 35.29 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.153 -0.967 . . . . 0.0 110.243 -179.997 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.9 mt-10 -68.31 -56.03 10.0 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.279 -0.888 . . . . 0.0 109.978 179.85 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . 0.534 ' CE2' ' HB3' ' B' ' 55' ' ' SER . 12.3 p90 -54.21 -37.15 64.25 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.22 -0.925 . . . . 0.0 110.228 179.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.53 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 63.8 tt0 -58.37 -48.32 80.97 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.214 -0.929 . . . . 0.0 110.206 -179.758 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp180 -59.14 -36.59 75.5 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.149 -0.969 . . . . 0.0 110.154 179.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.637 ' HA ' HD21 ' B' ' 63' ' ' LEU . 19.3 m-20 -61.31 -41.91 97.78 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.303 -0.873 . . . . 0.0 110.437 -179.882 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.474 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 61.6 mt-30 -65.91 -37.32 85.78 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.017 -1.052 . . . . 0.0 110.145 -179.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.546 ' CD1' ' N ' ' B' ' 63' ' ' LEU . 10.5 t80 -55.64 -63.57 1.13 Allowed 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.116 -0.99 . . . . 0.0 110.262 179.931 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.637 HD21 ' HA ' ' B' ' 60' ' ' ASP . 3.3 pp -59.93 -16.65 31.48 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.272 -0.892 . . . . 0.0 110.516 -179.487 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.448 ' HB3' ' O ' ' B' ' 60' ' ' ASP . 1.0 OUTLIER -84.5 -21.09 30.7 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.244 -0.91 . . . . 0.0 110.376 -179.86 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . 0.474 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 39.3 mt-30 -95.22 -62.85 1.23 Allowed 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.116 -0.99 . . . . 0.0 109.982 -179.778 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.477 ' H ' HG22 ' B' ' 66' ' ' VAL . 16.3 m -78.57 70.88 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.049 -1.032 . . . . 0.0 109.816 179.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 4.0 tptm -45.75 118.37 1.79 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.289 -0.882 . . . . 0.0 110.472 -179.702 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.478 HG12 ' HB ' ' B' ' 72' ' ' ILE . 0.9 OUTLIER -88.71 134.91 32.94 Favored Pre-proline 0 N--CA 1.486 1.35 0 O-C-N 121.232 -0.917 . . . . 0.0 110.331 -179.952 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.464 ' HG2' HD13 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -55.88 176.8 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.75 0 O-C-N 124.048 1.552 . . . . 0.0 110.663 -179.765 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.9 tptt -82.61 3.23 29.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.351 -0.843 . . . . 0.0 110.356 -179.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -84.15 -32.79 24.47 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.131 -0.981 . . . . 0.0 109.696 179.714 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.601 HD11 ' CG2' ' B' ' 13' ' ' THR . 2.0 mp -94.48 123.61 46.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 O-C-N 121.552 -0.717 . . . . 0.0 109.985 179.653 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.5 m -95.06 138.42 32.8 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.155 -0.965 . . . . 0.0 109.982 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.455 HG22 ' N ' ' B' ' 75' ' ' SER . 7.4 p -90.78 167.5 1.64 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.151 -0.968 . . . . 0.0 110.995 -178.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . 0.572 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.2 OUTLIER -143.62 157.65 44.25 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.763 -0.585 . . . . 0.0 110.173 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 11.2 p -133.49 133.57 42.39 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.082 -1.011 . . . . 0.0 110.281 179.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -157.87 -165.15 14.89 Favored Glycine 0 N--CA 1.49 2.238 0 N-CA-C 109.219 -1.552 . . . . 0.0 109.219 -179.908 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.404 ' O ' ' O ' ' A' ' 78' ' ' PHE . 55.7 m-85 -148.15 153.12 38.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.176 -1.19 . . . . 0.0 110.207 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 95.1 mmm -138.59 152.68 48.37 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.189 -0.944 . . . . 0.0 110.204 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 28.0 t -135.09 100.58 4.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 110.338 -179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 26.2 mt . . . . . 0 N--CA 1.491 1.614 0 CA-C-O 117.989 -1.005 . . . . 0.0 110.173 179.945 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.7 mtp . . . . . 0 N--CA 1.492 1.668 0 CA-C-O 121.183 0.516 . . . . 0.0 110.303 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.29 132.84 43.93 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.243 -0.91 . . . . 0.0 110.002 179.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.49 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 43.1 Cg_endo -91.2 166.19 3.65 Favored 'Trans proline' 0 C--N 1.305 -1.737 0 O-C-N 123.78 1.411 . . . . 0.0 110.668 179.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.438 HG21 ' HG3' ' A' ' 79' ' ' MET . 1.4 pt -144.05 179.62 1.39 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.692 0 O-C-N 121.408 -0.808 . . . . 0.0 110.154 179.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.534 HG13 ' CG2' ' A' ' 74' ' ' VAL . 1.0 OUTLIER -146.33 129.88 9.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 O-C-N 121.245 -0.909 . . . . 0.0 110.193 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.563 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.38 121.48 43.99 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.308 -0.87 . . . . 0.0 110.088 179.836 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 1.058 ' O ' HG23 ' A' ' 48' ' ' ILE . 4.2 tp -119.74 139.92 51.53 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.192 -0.943 . . . . 0.0 110.148 179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.514 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.6 ttpp -142.39 167.13 22.84 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.196 -0.94 . . . . 0.0 110.573 -179.711 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.514 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 154.74 -166.49 32.39 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.631 -1.388 . . . . 0.0 109.631 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.489 ' HB2' ' OG1' ' A' ' 13' ' ' THR . 65.4 m-20 -64.65 136.73 57.29 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.104 -1.233 . . . . 0.0 109.968 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.409 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.78 -46.57 59.64 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.274 -0.891 . . . . 0.0 111.169 -179.528 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -63.51 -46.8 84.38 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.118 -0.989 . . . . 0.0 111.196 -179.076 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.489 ' OG1' ' HB2' ' A' ' 10' ' ' ASP . 6.4 m -57.72 -31.19 66.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.901 -1.125 . . . . 0.0 110.383 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.483 HD12 ' O ' ' A' ' 10' ' ' ASP . 6.7 mt -75.06 -25.44 58.63 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.324 -0.86 . . . . 0.0 109.481 179.583 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.9 tttt -59.46 -40.63 87.52 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.545 -0.722 . . . . 0.0 110.294 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.489 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 22.4 t -70.12 -36.89 75.14 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.222 -0.924 . . . . 0.0 110.527 -179.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.5 mt -58.85 -54.79 43.09 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.244 -0.91 . . . . 0.0 110.085 -179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.493 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 26.9 ttt180 -47.28 -26.29 1.19 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.54 -0.725 . . . . 0.0 110.762 -179.897 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.489 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 10.9 t80 -64.92 -50.9 64.68 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.055 -1.028 . . . . 0.0 110.747 -179.475 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.48 -13.54 62.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.177 -0.952 . . . . 0.0 110.474 -179.659 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.493 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 2.4 m-30 -66.33 -35.4 80.26 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.203 -0.936 . . . . 0.0 110.076 179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.514 ' HE2' ' NE2' ' B' ' 40' ' ' HIS . 26.3 mmmt -63.52 -29.83 71.04 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.32 -0.862 . . . . 0.0 110.261 -179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 10.7 mmtt -74.91 -41.09 60.38 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.21 -0.931 . . . . 0.0 109.762 179.772 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.705 ' HB3' HD22 ' A' ' 27' ' ' LEU . 68.2 m-70 -95.14 37.27 1.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.32 -0.863 . . . . 0.0 109.94 179.676 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.605 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 8.7 p -57.22 -14.35 4.14 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.311 -0.868 . . . . 0.0 110.428 -179.832 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 24.1 p -96.72 6.67 48.23 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.103 -0.998 . . . . 0.0 110.182 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.705 HD22 ' HB3' ' A' ' 24' ' ' HIS . 6.6 mp -92.39 -35.04 13.91 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.238 -0.914 . . . . 0.0 110.376 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.605 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 39.3 p90 -111.05 165.77 11.61 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.189 -0.944 . . . . 0.0 110.187 179.947 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.06 -30.47 12.3 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.233 -0.917 . . . . 0.0 110.737 -179.59 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.568 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.66 114.48 2.37 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.226 -0.921 . . . . 0.0 110.557 -179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.766 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.7 p -89.98 99.69 9.83 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 O-C-N 121.119 -0.988 . . . . 0.0 110.135 179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.481 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -50.74 147.9 4.44 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.217 -0.927 . . . . 0.0 110.179 -179.9 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 4.7 t -60.82 164.47 4.75 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.085 -1.01 . . . . 0.0 109.829 179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.7 121.21 15.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.173 -0.954 . . . . 0.0 110.255 -179.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.532 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 55.7 p-90 -145.03 -177.56 5.6 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.235 -0.916 . . . . 0.0 109.605 -179.692 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.501 ' CD2' ' C ' ' A' ' 35' ' ' TRP . 0.8 OUTLIER -162.68 170.73 17.97 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.027 -1.045 . . . . 0.0 110.422 -179.833 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.418 ' CZ2' ' HH2' ' A' ' 35' ' ' TRP . 26.3 m95 -79.37 105.23 10.53 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.337 -0.852 . . . . 0.0 110.033 -179.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.588 ' O ' HG13 ' B' ' 31' ' ' VAL . 9.0 t -171.26 175.0 4.37 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.272 -0.893 . . . . 0.0 110.315 -179.964 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -121.58 -76.06 0.4 Allowed Glycine 0 N--CA 1.489 2.224 0 N-CA-C 109.533 -1.427 . . . . 0.0 109.533 179.877 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 7.6 m-70 -98.99 -87.38 0.35 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.206 -1.173 . . . . 0.0 109.943 179.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -116.85 153.34 32.69 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.327 -0.858 . . . . 0.0 109.985 179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -141.57 127.72 19.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.1 -1.0 . . . . 0.0 110.171 -179.998 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -85.52 -17.42 36.45 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.301 -0.874 . . . . 0.0 110.19 179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 37.2 m-70 -79.44 -139.4 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 0.0 110.085 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 14.8 mmmt -108.37 152.98 23.92 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.229 -0.919 . . . . 0.0 110.154 179.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.435 ' C ' ' HB3' ' A' ' 36' ' ' HIS . 0.1 OUTLIER -162.38 82.37 0.54 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.304 -0.873 . . . . 0.0 110.032 179.976 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -157.1 102.46 1.97 Allowed 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.25 -0.906 . . . . 0.0 110.268 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 1.058 HG23 ' O ' ' A' ' 7' ' ' LEU . 19.1 mt -141.96 148.81 20.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.336 -0.852 . . . . 0.0 109.678 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 97.2 t -126.69 113.12 31.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.104 -0.998 . . . . 0.0 110.654 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.414 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 94.6 m -93.86 156.88 16.41 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.221 -0.924 . . . . 0.0 109.809 179.688 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.414 ' HG ' ' O ' ' A' ' 50' ' ' THR . 1.6 mp -137.36 139.86 41.07 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.565 -179.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.568 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 0.0 OUTLIER -96.54 125.08 40.77 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.364 -0.835 . . . . 0.0 109.936 179.653 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.49 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 28.3 m-85 -107.79 148.71 29.14 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.312 -0.868 . . . . 0.0 110.445 -179.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -90.51 -16.78 28.24 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.297 -0.877 . . . . 0.0 110.38 -179.854 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 85.0 p -147.61 148.15 30.8 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.148 -0.97 . . . . 0.0 110.178 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.444 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 16.0 mt-10 -70.16 -36.97 75.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.232 -0.918 . . . . 0.0 110.209 -179.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 43.2 t-105 -53.78 -48.0 70.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.296 -0.877 . . . . 0.0 109.988 179.838 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.456 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 55.2 tt0 -57.07 -36.05 70.09 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.312 -0.867 . . . . 0.0 110.53 -179.178 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.444 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 1.1 ttp180 -59.62 -44.93 93.29 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.208 -0.933 . . . . 0.0 110.948 179.938 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.7 t70 -61.3 -40.58 94.7 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.111 -0.993 . . . . 0.0 111.391 -179.104 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.443 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 56.7 mt-30 -65.42 -43.33 90.85 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 120.886 -1.134 . . . . 0.0 110.743 -179.298 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.801 ' O ' HG22 ' A' ' 66' ' ' VAL . 15.9 t80 -55.96 -51.72 66.7 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.23 -0.919 . . . . 0.0 110.789 -179.662 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 43.1 mt -59.61 -14.74 14.76 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.199 -0.938 . . . . 0.0 110.605 -179.714 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 9.8 t -96.44 -21.91 17.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.12 -0.988 . . . . 0.0 110.897 -179.364 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 4.8 mt-30 -95.85 -34.19 11.95 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.071 -1.018 . . . . 0.0 110.438 -179.79 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.801 HG22 ' O ' ' A' ' 62' ' ' PHE . 19.5 m -87.03 109.12 18.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.101 -0.999 . . . . 0.0 110.624 -179.779 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -80.3 137.33 36.58 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.201 -0.937 . . . . 0.0 109.578 179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.561 HD11 HG21 ' A' ' 72' ' ' ILE . 18.2 tt -150.37 131.57 7.41 Favored Pre-proline 0 N--CA 1.487 1.386 0 O-C-N 121.011 -1.055 . . . . 0.0 110.739 -179.202 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.626 ' HG2' HG22 ' A' ' 71' ' ' THR . 43.6 Cg_endo -47.28 -178.39 0.0 OUTLIER 'Trans proline' 0 C--N 1.307 -1.627 0 O-C-N 124.246 1.656 . . . . 0.0 111.063 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -90.54 6.06 45.17 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.235 -0.915 . . . . 0.0 110.377 -179.68 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.862 HG23 HG12 ' A' ' 72' ' ' ILE . 9.8 t -84.21 -30.38 25.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.298 -0.876 . . . . 0.0 110.063 -179.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.862 HG12 HG23 ' A' ' 71' ' ' THR . 17.3 mm -94.86 103.23 14.47 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 O-C-N 121.151 -0.968 . . . . 0.0 110.233 179.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 74.4 m -95.35 157.78 15.74 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.243 -0.911 . . . . 0.0 109.997 179.902 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.615 ' HB ' HD12 ' A' ' 7' ' ' LEU . 9.8 p -145.85 157.88 12.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.147 -0.971 . . . . 0.0 110.592 -179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.59 -179.13 5.63 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.452 -0.78 . . . . 0.0 110.042 -179.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 29.5 p -107.4 170.46 7.95 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.109 -0.994 . . . . 0.0 110.79 -179.374 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.427 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -164.4 -174.07 33.76 Favored Glycine 0 N--CA 1.491 2.358 0 N-CA-C 109.327 -1.509 . . . . 0.0 109.327 179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' B' ' 78' ' ' PHE . 38.6 m-85 -148.1 142.08 25.88 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.223 -1.163 . . . . 0.0 110.69 -179.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.438 ' HG3' HG21 ' A' ' 4' ' ' ILE . 90.3 mmm -122.94 156.91 33.75 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.253 -0.904 . . . . 0.0 110.042 179.846 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.415 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.3 OUTLIER -135.62 102.74 5.2 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.349 -0.844 . . . . 0.0 110.146 179.972 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.415 HG23 ' C ' ' A' ' 80' ' ' SER . 14.4 pt . . . . . 0 N--CA 1.492 1.661 0 CA-C-O 118.037 -0.982 . . . . 0.0 110.289 -179.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 72.7 mtp . . . . . 0 N--CA 1.494 1.732 0 CA-C-O 121.185 0.517 . . . . 0.0 110.22 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 4.2 p -85.54 132.99 42.96 Favored Pre-proline 0 N--CA 1.491 1.604 0 O-C-N 121.188 -0.945 . . . . 0.0 109.964 179.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.497 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 44.2 Cg_endo -91.8 165.9 3.29 Favored 'Trans proline' 0 C--N 1.304 -1.776 0 O-C-N 123.923 1.486 . . . . 0.0 110.678 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.453 HG21 ' HG3' ' B' ' 79' ' ' MET . 1.4 pt -144.18 -179.92 1.26 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.354 -0.841 . . . . 0.0 110.216 -179.902 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.537 HG13 ' CG2' ' B' ' 74' ' ' VAL . 1.0 OUTLIER -146.59 130.94 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.119 -0.988 . . . . 0.0 110.213 -179.974 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.574 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -106.06 121.69 44.65 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.26 -0.9 . . . . 0.0 110.124 179.63 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 1.043 ' O ' HG23 ' B' ' 48' ' ' ILE . 4.2 tp -119.79 139.94 51.54 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.216 -0.928 . . . . 0.0 110.1 179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.508 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 9.9 ttpp -142.55 167.36 22.27 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.11 -0.994 . . . . 0.0 110.534 -179.701 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.508 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 154.74 -166.34 32.34 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 179.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . 0.499 ' HB2' ' OG1' ' B' ' 13' ' ' THR . 67.2 m-20 -64.99 136.42 56.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.129 -1.218 . . . . 0.0 109.752 179.866 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.431 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.57 -45.53 57.16 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.276 -0.89 . . . . 0.0 111.297 -179.511 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 7.2 p-10 -64.38 -46.3 83.94 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.121 -0.987 . . . . 0.0 111.117 -179.126 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.499 ' OG1' ' HB2' ' B' ' 10' ' ' ASP . 6.5 m -57.87 -31.57 66.83 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.026 -1.046 . . . . 0.0 110.345 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.461 HD12 ' O ' ' B' ' 10' ' ' ASP . 6.2 mt -74.93 -25.13 58.68 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.211 -0.931 . . . . 0.0 109.548 179.521 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.0 tttt -59.58 -40.31 86.98 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.438 -0.789 . . . . 0.0 110.069 179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.491 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.0 t -70.21 -37.25 75.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.308 -0.87 . . . . 0.0 110.473 -179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 17.1 mt -58.81 -54.62 45.08 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.19 -0.944 . . . . 0.0 110.17 -179.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.501 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 27.6 ttt180 -47.19 -26.19 1.1 Allowed 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.494 -0.754 . . . . 0.0 110.77 -179.945 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.491 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 11.1 t80 -65.03 -50.79 64.86 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.038 -1.039 . . . . 0.0 110.79 -179.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -69.66 -13.39 62.28 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.168 -0.958 . . . . 0.0 110.539 -179.609 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.501 ' HB2' ' O ' ' B' ' 18' ' ' ARG . 2.4 m-30 -66.48 -35.62 80.73 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.15 -0.969 . . . . 0.0 110.262 179.84 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 26.2 mmmt -63.33 -29.87 71.1 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.188 -0.945 . . . . 0.0 110.37 -179.921 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 10.3 mmtt -74.85 -41.26 60.19 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.108 -0.995 . . . . 0.0 109.831 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.721 ' HB3' HD22 ' B' ' 27' ' ' LEU . 66.7 m-70 -95.09 37.05 1.17 Allowed 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.34 -0.85 . . . . 0.0 109.861 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.611 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 7.7 p -57.07 -14.44 3.83 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.376 -0.827 . . . . 0.0 110.457 -179.816 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 27.5 p -96.35 6.77 48.07 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.168 -0.957 . . . . 0.0 110.103 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.721 HD22 ' HB3' ' B' ' 24' ' ' HIS . 6.5 mp -92.54 -35.5 13.56 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.3 -0.875 . . . . 0.0 110.315 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.611 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 37.5 p90 -110.54 166.21 11.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.147 -0.971 . . . . 0.0 110.197 179.863 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.7 -30.24 12.2 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.296 -0.878 . . . . 0.0 110.766 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.586 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.56 114.15 2.36 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.13 -0.981 . . . . 0.0 110.49 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.762 ' O ' HG13 ' B' ' 31' ' ' VAL . 12.1 p -90.02 99.36 9.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.506 0 O-C-N 121.097 -1.002 . . . . 0.0 109.725 179.333 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.532 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -50.87 148.28 4.28 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.117 -0.99 . . . . 0.0 110.102 -179.792 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . 0.405 ' HB3' ' HB2' ' A' ' 35' ' ' TRP . 3.9 t -60.98 164.62 4.79 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.177 -0.952 . . . . 0.0 109.894 -179.978 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.6 m -67.69 121.71 16.5 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.237 -0.914 . . . . 0.0 110.319 -179.705 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.5 ' C ' ' CD2' ' B' ' 36' ' ' HIS . 56.6 p-90 -145.34 -177.13 5.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.149 -0.969 . . . . 0.0 109.741 -179.855 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.5 ' CD2' ' C ' ' B' ' 35' ' ' TRP . 0.7 OUTLIER -162.67 170.45 18.43 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.033 -1.042 . . . . 0.0 110.41 179.987 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.428 ' CZ3' ' OG1' ' A' ' 52' ' ' THR . 26.4 m95 -79.26 104.93 10.22 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.273 -0.892 . . . . 0.0 109.937 179.852 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.678 ' O ' HG13 ' A' ' 31' ' ' VAL . 8.8 t -171.21 174.71 4.5 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.297 -0.877 . . . . 0.0 110.185 -179.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -121.6 -76.41 0.41 Allowed Glycine 0 N--CA 1.489 2.19 0 N-CA-C 109.456 -1.457 . . . . 0.0 109.456 179.803 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . 0.514 ' NE2' ' HE2' ' A' ' 22' ' ' LYS . 6.8 m-70 -98.11 -87.63 0.33 Allowed 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.248 -1.148 . . . . 0.0 110.153 179.774 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 25.7 t-20 -117.18 152.74 34.15 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.325 -0.86 . . . . 0.0 110.05 179.837 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -140.78 127.65 21.65 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.701 0 O-C-N 121.212 -0.93 . . . . 0.0 110.373 -179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 4.2 tttt -85.32 -18.18 34.61 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.334 -0.853 . . . . 0.0 109.986 179.742 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 37.1 m-70 -78.45 -139.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.296 -0.877 . . . . 0.0 110.079 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 15.4 mmmt -108.6 151.44 26.12 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.172 -0.955 . . . . 0.0 110.085 179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.441 ' C ' ' HB3' ' B' ' 36' ' ' HIS . 0.1 OUTLIER -160.88 82.12 0.65 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.195 -0.941 . . . . 0.0 110.135 179.952 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -156.64 102.15 2.03 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.241 -0.912 . . . . 0.0 110.416 -179.948 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 1.043 HG23 ' O ' ' B' ' 7' ' ' LEU . 19.7 mt -141.64 149.16 20.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.314 -0.866 . . . . 0.0 109.704 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 93.1 t -126.91 113.28 32.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.112 -0.992 . . . . 0.0 110.626 -179.664 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.419 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 97.7 m -94.26 156.86 16.32 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.25 -0.906 . . . . 0.0 109.899 179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.41 ' HG ' ' O ' ' B' ' 50' ' ' THR . 1.7 mp -137.22 139.84 41.31 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.045 -1.034 . . . . 0.0 110.623 -179.913 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.586 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 0.0 OUTLIER -96.67 125.18 40.96 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.295 -0.878 . . . . 0.0 109.904 179.728 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.497 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 28.9 m-85 -107.99 149.08 28.84 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.27 -0.894 . . . . 0.0 110.528 -179.675 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -90.84 -16.59 28.01 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.407 -0.808 . . . . 0.0 110.17 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 85.1 p -147.83 146.7 29.21 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.236 -0.915 . . . . 0.0 110.453 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 15.6 mt-10 -68.71 -37.64 79.65 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.231 -0.918 . . . . 0.0 110.152 179.824 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . 0.416 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 44.3 t-105 -53.7 -48.32 69.67 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.318 -0.864 . . . . 0.0 110.112 179.994 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.491 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 54.5 tt0 -56.8 -35.72 69.07 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.408 -0.807 . . . . 0.0 110.453 -179.203 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.462 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 1.1 ttp180 -59.83 -45.44 92.39 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.042 -1.036 . . . . 0.0 110.979 179.984 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -60.95 -40.23 92.53 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.163 -0.96 . . . . 0.0 111.235 -179.024 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.454 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 57.4 mt-30 -65.62 -43.44 89.58 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.051 -1.031 . . . . 0.0 110.73 -179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.793 ' O ' HG22 ' B' ' 66' ' ' VAL . 17.1 t80 -55.88 -51.66 66.79 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.286 -0.884 . . . . 0.0 110.672 -179.598 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 36.4 mt -59.78 -15.51 20.98 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.134 -0.979 . . . . 0.0 110.765 -179.528 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 10.6 t -95.49 -21.99 17.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.117 -0.989 . . . . 0.0 110.974 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . 0.454 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 4.6 mt-30 -95.91 -33.06 12.33 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.079 -1.013 . . . . 0.0 110.545 -179.657 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.793 HG22 ' O ' ' B' ' 62' ' ' PHE . 20.1 m -88.3 109.43 19.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.208 -0.932 . . . . 0.0 110.616 -179.822 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 2.1 ttpm? -79.97 137.29 36.81 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.189 -0.945 . . . . 0.0 109.507 179.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.556 HD11 HG21 ' B' ' 72' ' ' ILE . 18.4 tt -150.3 131.68 7.5 Favored Pre-proline 0 C--N 1.305 -1.369 0 O-C-N 120.993 -1.067 . . . . 0.0 110.518 -179.262 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.615 ' HG2' HG22 ' B' ' 71' ' ' THR . 42.2 Cg_endo -47.93 -179.34 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.711 0 O-C-N 124.148 1.604 . . . . 0.0 110.942 -179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -89.48 5.75 43.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.37 -0.831 . . . . 0.0 110.481 -179.618 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . 0.874 HG23 HG12 ' B' ' 72' ' ' ILE . 9.4 t -84.17 -30.58 25.71 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.158 -0.964 . . . . 0.0 110.227 -179.731 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.874 HG12 HG23 ' B' ' 71' ' ' THR . 16.8 mm -94.6 103.52 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.218 -0.926 . . . . 0.0 110.254 179.721 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 63.2 m -95.41 157.39 15.92 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.237 -0.914 . . . . 0.0 110.204 179.946 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.616 ' HB ' HD12 ' B' ' 7' ' ' LEU . 9.8 p -145.64 157.49 12.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.059 -1.026 . . . . 0.0 110.743 -179.433 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -138.3 -178.99 5.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.496 -0.753 . . . . 0.0 109.875 -179.712 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.5 p -107.15 171.91 7.12 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.102 -0.999 . . . . 0.0 110.773 -179.481 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.447 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -164.98 -175.1 35.4 Favored Glycine 0 N--CA 1.491 2.314 0 N-CA-C 109.322 -1.511 . . . . 0.0 109.322 -179.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.505 ' O ' ' O ' ' A' ' 78' ' ' PHE . 36.8 m-85 -147.8 140.57 24.75 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.273 -1.133 . . . . 0.0 110.462 179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.453 ' HG3' HG21 ' B' ' 4' ' ' ILE . 89.6 mmm -121.99 157.53 31.12 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.181 -0.949 . . . . 0.0 110.033 179.903 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.407 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.3 OUTLIER -135.84 103.51 5.42 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.239 -0.913 . . . . 0.0 110.178 -179.938 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.407 HG23 ' C ' ' B' ' 80' ' ' SER . 13.8 pt . . . . . 0 N--CA 1.491 1.595 0 CA-C-O 117.978 -1.01 . . . . 0.0 110.18 179.961 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 121.252 0.549 . . . . 0.0 110.313 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 2.8 m -72.33 123.62 89.74 Favored Pre-proline 0 N--CA 1.491 1.6 0 O-C-N 121.286 -0.884 . . . . 0.0 110.256 -179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.562 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.7 Cg_endo -76.92 153.06 32.6 Favored 'Trans proline' 0 C--N 1.306 -1.667 0 O-C-N 123.947 1.498 . . . . 0.0 110.296 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.653 HD11 ' HA3' ' A' ' 77' ' ' GLY . 0.8 OUTLIER -144.2 176.4 2.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.75 0 O-C-N 121.303 -0.873 . . . . 0.0 110.306 179.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.482 HG23 ' HB2' ' A' ' 51' ' ' LEU . 2.4 m -146.33 129.05 8.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.313 -0.867 . . . . 0.0 110.214 179.848 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.494 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 1.1 m170 -104.98 116.51 32.08 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.26 -0.9 . . . . 0.0 109.936 179.673 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.582 HD12 ' O ' ' A' ' 49' ' ' VAL . 1.0 OUTLIER -109.75 142.51 40.87 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.225 -0.922 . . . . 0.0 110.142 -179.793 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.914 ' HD3' HD11 ' A' ' 48' ' ' ILE . 14.9 ttpt -141.5 166.48 24.64 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.261 -0.899 . . . . 0.0 110.492 -179.788 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.25 -160.05 29.23 Favored Glycine 0 N--CA 1.491 2.324 0 N-CA-C 109.461 -1.456 . . . . 0.0 109.461 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -65.04 136.52 56.86 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.189 -1.183 . . . . 0.0 110.3 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.99 -29.59 8.89 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.301 -0.874 . . . . 0.0 110.52 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 78.7 m-20 -78.01 -46.3 21.38 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.106 -0.996 . . . . 0.0 110.173 -179.934 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 92.7 m -58.1 -14.08 6.09 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.389 -0.82 . . . . 0.0 110.419 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.561 ' HA ' HD12 ' A' ' 17' ' ' LEU . 16.0 mt -87.62 -38.39 15.95 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.176 -0.953 . . . . 0.0 110.423 -179.819 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.03 -37.39 79.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.221 -0.924 . . . . 0.0 110.227 179.786 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.45 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 8.0 t -70.08 -37.29 75.42 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.317 -0.864 . . . . 0.0 110.558 -179.699 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.599 HD11 HG13 ' A' ' 72' ' ' ILE . 19.1 mt -58.75 -48.84 79.79 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.079 -1.013 . . . . 0.0 110.223 179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.587 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 19.5 ttm180 -47.69 -37.3 12.74 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.253 -0.905 . . . . 0.0 110.253 179.573 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.45 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 18.1 t80 -64.76 -31.25 72.4 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.444 -0.785 . . . . 0.0 110.627 -179.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.451 ' NH1' ' HE3' ' A' ' 67' ' ' LYS . 6.2 mmt180 -70.42 -30.54 67.43 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.147 -0.971 . . . . 0.0 110.205 179.987 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.587 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 7.1 m-30 -66.63 -17.26 64.74 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.269 -0.894 . . . . 0.0 110.327 -179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.8 mmtt -63.63 -33.0 74.65 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.146 -0.971 . . . . 0.0 110.305 -179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.509 ' O ' ' ND1' ' A' ' 24' ' ' HIS . 4.1 mmtp -75.03 -10.87 59.88 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.205 -0.934 . . . . 0.0 110.225 -179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.875 ' CB ' HD22 ' A' ' 27' ' ' LEU . 8.0 m-70 -144.7 46.32 1.37 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.215 -0.928 . . . . 0.0 109.928 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.534 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 11.3 t -57.43 -14.87 5.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.305 -0.872 . . . . 0.0 110.464 -179.808 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 1.6 p -96.48 17.01 17.06 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.139 -0.976 . . . . 0.0 110.325 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.875 HD22 ' CB ' ' A' ' 24' ' ' HIS . 5.0 mp -92.41 -35.11 13.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.248 -0.908 . . . . 0.0 110.017 179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.534 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 16.8 p90 -108.03 172.75 6.66 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.208 -0.933 . . . . 0.0 109.994 179.755 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 96.4 m -99.82 -32.05 11.21 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.198 -0.938 . . . . 0.0 111.372 -179.186 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.75 119.89 3.0 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.859 -1.151 . . . . 0.0 111.143 -179.661 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.644 ' O ' HG13 ' A' ' 31' ' ' VAL . 9.4 p -89.1 114.9 27.96 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.293 -0.879 . . . . 0.0 109.655 179.213 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.614 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.1 OUTLIER -83.79 152.78 24.46 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.149 -0.969 . . . . 0.0 110.671 -179.566 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 60.4 p -61.36 164.79 5.19 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.322 -0.861 . . . . 0.0 110.425 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 3.3 m -68.12 126.17 28.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.355 -0.841 . . . . 0.0 110.239 179.974 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.592 ' CZ3' ' CB ' ' B' ' 32' ' ' SER . 1.6 p-90 -145.46 164.4 31.68 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.042 -1.036 . . . . 0.0 109.438 -179.516 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.426 ' C ' ' CD2' ' A' ' 36' ' ' HIS . 2.0 p-80 -162.45 -178.72 6.45 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.967 -1.083 . . . . 0.0 110.973 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.481 ' O ' ' HB ' ' A' ' 38' ' ' THR . 33.7 m95 -79.55 126.49 30.94 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.525 -0.734 . . . . 0.0 110.664 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.481 ' HB ' ' O ' ' A' ' 37' ' ' TRP . 0.6 OUTLIER 178.72 152.48 0.34 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.329 -0.857 . . . . 0.0 110.063 179.53 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -81.83 -41.9 9.35 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 -179.879 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.78 ' O ' HG13 ' A' ' 42' ' ' VAL . 12.1 t-80 -159.81 176.98 11.29 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.225 -1.162 . . . . 0.0 110.104 179.951 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.3 m120 -54.64 86.2 0.0 OUTLIER 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.128 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.78 HG13 ' O ' ' A' ' 40' ' ' HIS . 12.7 m -122.11 -17.72 5.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.283 -0.885 . . . . 0.0 110.122 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.402 ' HG2' ' O ' ' A' ' 42' ' ' VAL . 0.4 OUTLIER -147.47 132.7 18.41 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.302 -0.874 . . . . 0.0 110.13 179.888 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -101.1 4.33 42.08 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.19 -0.944 . . . . 0.0 110.375 -179.98 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.42 ' O ' ' C ' ' A' ' 46' ' ' SER . 27.7 tttp -81.67 -60.07 2.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.242 -0.911 . . . . 0.0 110.201 179.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.469 ' O ' ' HB2' ' A' ' 47' ' ' ALA . 0.4 OUTLIER -43.36 149.64 0.24 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.134 -0.979 . . . . 0.0 110.143 179.978 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.469 ' HB2' ' O ' ' A' ' 46' ' ' SER . . . -178.63 126.04 0.1 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.185 -0.947 . . . . 0.0 110.156 179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.914 HD11 ' HD3' ' A' ' 8' ' ' LYS . 20.0 mt -142.49 147.31 21.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.22 -0.925 . . . . 0.0 110.248 -179.724 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.582 ' O ' HD12 ' A' ' 7' ' ' LEU . 21.3 t -125.36 119.93 56.66 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.294 -0.879 . . . . 0.0 110.234 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.494 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 16.0 m -94.22 151.86 19.14 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.256 -0.902 . . . . 0.0 110.132 179.897 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.482 ' HB2' HG23 ' A' ' 5' ' ' VAL . 0.2 OUTLIER -137.08 131.73 33.15 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.271 -0.893 . . . . 0.0 110.07 179.642 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.473 ' HA ' HG22 ' A' ' 4' ' ' ILE . 40.2 p -97.77 136.37 38.21 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.367 -0.833 . . . . 0.0 110.239 179.792 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.562 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 37.5 m-85 -116.16 153.99 30.82 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.225 -0.922 . . . . 0.0 110.125 179.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -89.92 -13.88 35.37 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.25 -0.907 . . . . 0.0 110.768 -179.133 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.591 ' HB3' ' CE2' ' A' ' 57' ' ' TRP . 1.7 m -142.28 151.13 41.73 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.044 -1.035 . . . . 0.0 110.221 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -70.97 -53.9 13.23 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.309 -0.869 . . . . 0.0 110.363 -179.905 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.668 ' CD1' ' N ' ' A' ' 58' ' ' GLN . 6.9 p90 -54.03 -35.16 61.64 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.098 -1.001 . . . . 0.0 110.063 -179.94 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.668 ' N ' ' CD1' ' A' ' 57' ' ' TRP . 33.3 tt0 -56.89 -37.76 71.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.186 -0.946 . . . . 0.0 110.024 -179.356 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 42.9 ttp180 -59.59 -40.21 86.7 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.191 -0.943 . . . . 0.0 109.841 179.184 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.658 ' HA ' HD12 ' A' ' 63' ' ' LEU . 96.5 m-20 -61.08 -40.36 93.4 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.329 -0.857 . . . . 0.0 110.458 179.988 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.489 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 64.4 mt-30 -65.66 -40.68 92.69 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.224 -0.923 . . . . 0.0 110.36 -179.809 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.681 ' CE2' HG21 ' A' ' 66' ' ' VAL . 85.9 t80 -55.7 -39.81 71.54 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.108 -0.995 . . . . 0.0 109.531 179.65 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.658 HD12 ' HA ' ' A' ' 60' ' ' ASP . 62.2 mt -58.89 -27.64 65.41 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.389 -0.819 . . . . 0.0 109.713 179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.429 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 8.5 p -96.37 -6.21 38.12 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.282 -0.886 . . . . 0.0 109.794 179.473 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.517 ' CG ' HD21 ' A' ' 27' ' ' LEU . 20.0 mm-40 -95.23 -28.36 15.06 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.394 -0.817 . . . . 0.0 109.741 179.774 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.722 ' O ' HG23 ' A' ' 66' ' ' VAL . 33.3 m -131.26 85.47 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.324 -0.86 . . . . 0.0 109.863 179.767 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.451 ' HE3' ' NH1' ' A' ' 20' ' ' ARG . 7.4 pttp -41.85 135.82 2.21 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.237 -0.914 . . . . 0.0 110.423 -179.733 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.487 HD12 ' O ' ' A' ' 66' ' ' VAL . 1.4 mp -88.41 148.69 42.94 Favored Pre-proline 0 N--CA 1.491 1.621 0 O-C-N 121.369 -0.832 . . . . 0.0 110.126 179.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.527 ' CG ' ' CG1' ' A' ' 72' ' ' ILE . 46.3 Cg_endo -70.81 -160.06 0.07 OUTLIER 'Trans proline' 0 C--N 1.302 -1.872 0 O-C-N 124.163 1.612 . . . . 0.0 110.579 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.551 ' O ' HG23 ' A' ' 71' ' ' THR . 0.3 OUTLIER -104.9 24.61 11.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.264 -0.898 . . . . 0.0 110.307 -179.93 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.551 HG23 ' O ' ' A' ' 70' ' ' LYS . 1.9 p -154.42 3.15 0.23 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.255 -0.903 . . . . 0.0 111.441 -179.747 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.75 HD13 ' O ' ' A' ' 8' ' ' LYS . 9.6 mm -95.12 121.16 45.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 120.807 -1.183 . . . . 0.0 109.901 179.471 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.469 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 1.7 m -94.86 129.81 41.7 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.107 -0.996 . . . . 0.0 110.29 -179.862 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.562 ' O ' HG13 ' A' ' 74' ' ' VAL . 2.9 p -112.02 100.37 10.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.476 -0.765 . . . . 0.0 109.822 178.513 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -100.02 175.99 5.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.746 -1.221 . . . . 0.0 110.536 -179.8 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 28.9 p -109.06 153.26 23.9 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.233 -0.917 . . . . 0.0 110.025 179.915 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.653 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -162.16 178.36 38.0 Favored Glycine 0 N--CA 1.49 2.273 0 N-CA-C 109.401 -1.48 . . . . 0.0 109.401 179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -147.84 139.14 23.58 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.269 -1.136 . . . . 0.0 110.263 -179.922 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.417 ' SD ' ' CE1' ' B' ' 6' ' ' HIS . 2.1 mtm -126.01 138.21 53.72 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.214 -0.929 . . . . 0.0 110.108 179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.26 101.82 6.91 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.23 -0.918 . . . . 0.0 110.336 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 4.1 mt . . . . . 0 N--CA 1.491 1.6 0 CA-C-O 118.013 -0.994 . . . . 0.0 110.19 179.879 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.491 1.618 0 CA-C-O 121.244 0.545 . . . . 0.0 110.24 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 3.0 m -71.96 123.76 89.91 Favored Pre-proline 0 N--CA 1.491 1.616 0 O-C-N 121.34 -0.85 . . . . 0.0 110.279 179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.561 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -76.97 153.21 32.47 Favored 'Trans proline' 0 C--N 1.305 -1.716 0 O-C-N 123.997 1.525 . . . . 0.0 110.262 179.721 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.659 HD11 ' HA3' ' B' ' 77' ' ' GLY . 0.7 OUTLIER -144.28 176.07 2.8 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.745 0 O-C-N 121.324 -0.86 . . . . 0.0 110.245 179.822 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.467 HG23 ' HB2' ' B' ' 51' ' ' LEU . 2.5 m -146.05 128.86 9.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.33 -0.856 . . . . 0.0 110.179 179.698 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.469 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.1 m170 -104.57 118.57 36.92 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.255 -0.903 . . . . 0.0 109.624 179.693 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.573 HD12 ' O ' ' B' ' 49' ' ' VAL . 1.0 OUTLIER -111.69 142.37 44.11 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.426 -0.796 . . . . 0.0 110.139 -179.698 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.91 ' HD3' HD11 ' B' ' 48' ' ' ILE . 15.0 ttpt -141.64 166.05 25.81 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.249 -0.907 . . . . 0.0 110.482 -179.742 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 154.85 -160.14 29.48 Favored Glycine 0 N--CA 1.491 2.346 0 N-CA-C 109.528 -1.429 . . . . 0.0 109.528 -179.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -64.98 136.17 56.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.279 -1.13 . . . . 0.0 110.158 179.878 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.83 -30.19 9.37 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.271 -0.893 . . . . 0.0 110.305 -179.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 76.8 m-20 -76.82 -46.76 23.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.254 -0.904 . . . . 0.0 110.223 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 94.3 m -57.96 -15.24 8.22 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.32 -0.862 . . . . 0.0 110.533 -179.801 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.585 ' HA ' HD12 ' B' ' 17' ' ' LEU . 16.6 mt -86.4 -38.07 17.75 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.177 -0.952 . . . . 0.0 110.561 -179.78 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -60.1 -37.53 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.199 -0.938 . . . . 0.0 110.325 179.867 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.471 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 8.4 t -69.93 -37.22 75.83 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.229 -0.919 . . . . 0.0 110.344 -179.651 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.585 HD12 ' HA ' ' B' ' 14' ' ' LEU . 19.8 mt -58.69 -49.03 79.07 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.231 -179.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.584 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 19.1 ttm180 -47.93 -36.62 12.68 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.409 -0.807 . . . . 0.0 110.151 179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.471 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 21.9 t80 -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.427 -0.796 . . . . 0.0 110.503 -179.556 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.457 ' NH1' ' HE3' ' B' ' 67' ' ' LYS . 6.3 mmt180 -69.83 -31.05 68.72 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.228 -0.92 . . . . 0.0 110.33 -179.849 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.584 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 7.2 m-30 -66.4 -17.21 64.65 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.199 -0.938 . . . . 0.0 110.317 -179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.1 mmtt -63.46 -32.83 74.38 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.26 -0.9 . . . . 0.0 110.191 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . 0.507 ' O ' ' ND1' ' B' ' 24' ' ' HIS . 4.0 mmtp -75.26 -10.67 59.67 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.208 -0.933 . . . . 0.0 110.214 -179.919 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.877 ' CB ' HD22 ' B' ' 27' ' ' LEU . 8.6 m-70 -145.06 46.46 1.33 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.229 -0.919 . . . . 0.0 109.998 179.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.567 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 13.9 t -57.29 -14.54 4.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.258 -0.902 . . . . 0.0 110.565 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 1.5 p -96.59 16.26 19.35 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.251 -0.905 . . . . 0.0 110.294 -179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.877 HD22 ' CB ' ' B' ' 24' ' ' HIS . 5.2 mp -92.12 -34.08 14.5 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.186 -0.946 . . . . 0.0 110.025 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.567 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 17.1 p90 -108.37 172.54 6.78 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.259 -0.9 . . . . 0.0 110.048 179.729 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 95.3 m -99.97 -32.11 11.13 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.157 -0.965 . . . . 0.0 111.283 -179.128 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.86 119.88 2.96 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 120.899 -1.126 . . . . 0.0 111.013 -179.619 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.632 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.3 p -89.46 115.2 28.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.277 -0.889 . . . . 0.0 109.567 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.592 ' CB ' ' CZ3' ' A' ' 35' ' ' TRP . 0.1 OUTLIER -83.92 153.34 24.01 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.204 -0.935 . . . . 0.0 110.74 -179.417 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 60.3 p -61.56 164.44 5.89 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.328 -0.858 . . . . 0.0 110.314 179.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 3.5 m -68.05 126.45 29.54 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.287 -0.883 . . . . 0.0 110.25 179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.614 ' CZ3' ' CB ' ' A' ' 32' ' ' SER . 1.7 p-90 -145.71 164.93 30.26 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.014 -1.054 . . . . 0.0 109.567 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.417 ' CD2' ' C ' ' B' ' 36' ' ' HIS . 2.0 p-80 -162.46 -177.91 5.93 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.951 -1.093 . . . . 0.0 110.972 -179.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.496 ' O ' ' HB ' ' B' ' 38' ' ' THR . 34.1 m95 -79.87 127.0 31.72 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.415 -0.803 . . . . 0.0 110.507 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.567 ' O ' HG13 ' A' ' 31' ' ' VAL . 0.6 OUTLIER 178.12 151.88 0.27 Allowed 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.271 -0.893 . . . . 0.0 110.167 179.492 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -81.13 -42.67 9.27 Favored Glycine 0 N--CA 1.49 2.26 0 N-CA-C 109.478 -1.449 . . . . 0.0 109.478 179.908 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . 0.733 ' O ' HG13 ' B' ' 42' ' ' VAL . 11.4 t-80 -159.11 178.06 10.43 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.194 -1.18 . . . . 0.0 110.206 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 19.0 m120 -55.42 85.17 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.271 -0.893 . . . . 0.0 110.074 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.733 HG13 ' O ' ' B' ' 40' ' ' HIS . 13.5 m -121.21 -17.66 5.68 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.174 -0.954 . . . . 0.0 110.367 -179.904 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -147.4 132.74 18.52 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.25 -0.907 . . . . 0.0 109.968 179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -100.91 3.63 41.93 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.255 -0.903 . . . . 0.0 110.373 -179.937 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . 0.423 ' O ' ' C ' ' B' ' 46' ' ' SER . 28.1 tttp -80.84 -61.14 2.05 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.209 -0.932 . . . . 0.0 110.146 179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.479 ' O ' ' HB2' ' B' ' 47' ' ' ALA . 0.3 OUTLIER -42.45 149.68 0.16 Allowed 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.295 -0.878 . . . . 0.0 110.297 -179.933 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' B' ' 46' ' ' SER . . . -178.91 126.1 0.1 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.279 -0.888 . . . . 0.0 110.191 179.991 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.91 HD11 ' HD3' ' B' ' 8' ' ' LYS . 20.1 mt -142.48 146.84 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.274 -0.891 . . . . 0.0 110.318 -179.686 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.573 ' O ' HD12 ' B' ' 7' ' ' LEU . 21.4 t -124.65 120.31 58.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.289 -0.882 . . . . 0.0 110.163 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.469 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 16.7 m -94.35 151.22 19.57 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.073 179.85 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.477 HD23 ' HB2' ' B' ' 28' ' ' TYR . 0.2 OUTLIER -136.83 131.76 33.7 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.216 -0.927 . . . . 0.0 110.165 179.709 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.445 ' HA ' HG22 ' B' ' 4' ' ' ILE . 40.8 p -98.01 136.2 38.62 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.368 -0.833 . . . . 0.0 110.364 179.953 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.561 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 37.6 m-85 -116.18 154.13 30.6 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.232 -0.918 . . . . 0.0 110.147 179.867 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 11.6 m-20 -90.07 -14.38 33.92 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.175 -0.953 . . . . 0.0 110.736 -179.222 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . 0.607 ' HB3' ' CE2' ' B' ' 57' ' ' TRP . 1.7 m -141.39 151.73 43.73 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.105 -0.997 . . . . 0.0 110.21 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -71.92 -53.55 12.76 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.23 -0.919 . . . . 0.0 110.37 -179.852 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . 0.67 ' CD1' ' N ' ' B' ' 58' ' ' GLN . 6.3 p90 -53.92 -34.84 60.74 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.109 -0.995 . . . . 0.0 109.945 179.923 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.67 ' N ' ' CD1' ' B' ' 57' ' ' TRP . 32.5 tt0 -57.0 -38.31 72.91 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.08 -1.012 . . . . 0.0 110.033 -179.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 43.0 ttp180 -59.48 -39.71 84.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.226 -0.921 . . . . 0.0 109.927 179.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.637 ' HA ' HD12 ' B' ' 63' ' ' LEU . 96.6 m-20 -61.31 -39.97 92.45 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.317 -0.865 . . . . 0.0 110.216 179.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.479 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 65.3 mt-30 -65.85 -41.31 91.87 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.287 -0.883 . . . . 0.0 110.475 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.658 ' CE2' HG21 ' B' ' 66' ' ' VAL . 85.8 t80 -55.62 -39.5 70.89 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.196 -0.94 . . . . 0.0 109.53 179.657 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.637 HD12 ' HA ' ' B' ' 60' ' ' ASP . 67.1 mt -58.89 -27.25 65.04 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.472 -0.767 . . . . 0.0 109.827 179.505 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.433 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 6.5 p -96.95 -6.11 36.32 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.368 -0.832 . . . . 0.0 109.92 179.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . 0.514 ' CG ' HD21 ' B' ' 27' ' ' LEU . 19.5 mm-40 -95.13 -29.01 14.78 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.33 -0.856 . . . . 0.0 109.659 179.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.729 HG23 ' O ' ' B' ' 66' ' ' VAL . 33.1 m -130.55 86.69 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.443 -0.786 . . . . 0.0 109.79 179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.457 ' HE3' ' NH1' ' B' ' 20' ' ' ARG . 6.9 pttp -43.15 136.18 2.98 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.242 -0.911 . . . . 0.0 110.278 -179.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.472 HD12 ' O ' ' B' ' 66' ' ' VAL . 1.4 mp -88.49 148.61 42.58 Favored Pre-proline 0 N--CA 1.491 1.586 0 O-C-N 121.24 -0.912 . . . . 0.0 109.992 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.539 ' HG2' ' CG1' ' B' ' 72' ' ' ILE . 45.0 Cg_endo -71.0 -160.33 0.08 OUTLIER 'Trans proline' 0 C--N 1.306 -1.701 0 O-C-N 124.1 1.579 . . . . 0.0 110.553 179.914 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.554 ' O ' HG23 ' B' ' 71' ' ' THR . 0.4 OUTLIER -104.43 24.77 11.1 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.136 -0.978 . . . . 0.0 110.44 -179.868 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . 0.554 HG23 ' O ' ' B' ' 70' ' ' LYS . 2.1 p -154.49 3.67 0.24 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.15 -0.969 . . . . 0.0 111.397 -179.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.765 HD13 ' O ' ' B' ' 8' ' ' LYS . 9.8 mm -95.48 121.49 46.08 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.774 -1.204 . . . . 0.0 109.917 179.497 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . 0.46 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 1.6 m -95.28 129.61 42.34 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.202 -0.936 . . . . 0.0 110.394 -179.918 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.54 HG13 ' O ' ' B' ' 74' ' ' VAL . 2.6 p -111.65 99.86 9.56 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.497 -0.752 . . . . 0.0 109.803 178.57 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -99.92 174.86 5.99 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.656 -1.278 . . . . 0.0 110.424 -179.692 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 30.1 p -107.8 152.93 23.72 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.402 -0.811 . . . . 0.0 110.149 179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.659 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -161.45 178.49 37.34 Favored Glycine 0 N--CA 1.489 2.21 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 -179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -147.97 139.39 23.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.25 -1.147 . . . . 0.0 110.256 179.968 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.0 mtm -126.36 139.14 53.52 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.129 -0.982 . . . . 0.0 110.13 179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 1.5 m -126.89 101.71 6.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -0.931 . . . . 0.0 110.303 -179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.411 ' OXT' HG22 ' B' ' 81' ' ' ILE . 4.1 mt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.07 -0.966 . . . . 0.0 110.207 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.458 ' HB3' ' HB3' ' A' ' 78' ' ' PHE . 0.9 OUTLIER . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 121.297 0.57 . . . . 0.0 110.138 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.456 ' O ' HG23 ' A' ' 4' ' ' ILE . 66.8 p -96.23 106.68 30.4 Favored Pre-proline 0 N--CA 1.491 1.605 0 O-C-N 121.173 -0.954 . . . . 0.0 110.384 -179.856 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.415 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 48.5 Cg_endo -52.82 155.7 10.42 Favored 'Trans proline' 0 C--N 1.303 -1.829 0 O-C-N 124.034 1.544 . . . . 0.0 110.315 179.815 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.456 HG23 ' O ' ' A' ' 2' ' ' THR . 7.1 pt -143.47 178.69 1.83 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.266 -0.896 . . . . 0.0 110.303 -179.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.663 HG13 ' CG1' ' A' ' 74' ' ' VAL . 40.3 t -145.53 136.04 18.95 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.281 -0.887 . . . . 0.0 110.381 -179.601 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.558 ' O ' HG22 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.54 121.4 43.88 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.329 -0.857 . . . . 0.0 109.795 179.647 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.637 HD12 HG12 ' A' ' 5' ' ' VAL . 0.4 OUTLIER -115.51 123.81 49.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.271 -0.893 . . . . 0.0 110.546 -179.743 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.622 ' HD2' HD11 ' A' ' 48' ' ' ILE . 18.8 tttt -141.48 166.22 25.35 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.236 -0.915 . . . . 0.0 110.209 -179.854 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.531 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 141.88 -146.07 16.87 Favored Glycine 0 N--CA 1.49 2.235 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.92 121.38 14.51 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.322 -1.105 . . . . 0.0 110.332 -179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.18 -35.96 28.49 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.354 -0.841 . . . . 0.0 110.733 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -75.01 -43.79 51.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.154 -0.966 . . . . 0.0 110.64 -179.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 47.6 m -57.86 -27.01 62.85 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.206 -0.934 . . . . 0.0 110.507 -179.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.769 ' HA ' HD12 ' A' ' 17' ' ' LEU . 15.7 mt -82.67 -34.45 27.4 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.271 -0.893 . . . . 0.0 110.027 179.897 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.6 ttmt -59.78 -39.12 83.84 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.25 -0.906 . . . . 0.0 110.117 179.743 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.505 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 35.9 t -70.21 -37.84 75.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.407 -0.808 . . . . 0.0 110.571 -179.845 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.769 HD12 ' HA ' ' A' ' 14' ' ' LEU . 22.7 mt -58.66 -50.56 73.41 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.086 -1.009 . . . . 0.0 110.166 -179.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.408 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 18.1 ttm105 -46.98 -29.15 1.91 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.367 -0.833 . . . . 0.0 110.307 179.867 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.505 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 72.0 t80 -64.81 -42.12 95.24 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.234 -0.916 . . . . 0.0 110.503 -179.725 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 25.5 mtt-85 -70.99 -26.24 63.05 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.218 -0.926 . . . . 0.0 110.157 -179.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.551 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.1 m-30 -66.55 -20.37 66.0 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.217 -0.927 . . . . 0.0 110.398 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 21.4 mmtp -63.29 -27.7 69.51 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.224 -0.923 . . . . 0.0 110.42 -179.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 25.6 mmtm -75.13 -48.4 23.91 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.476 -179.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.431 ' CB ' HD12 ' A' ' 27' ' ' LEU . 20.1 m-70 -94.84 52.85 1.53 Allowed 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.204 -0.935 . . . . 0.0 110.228 -179.695 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 20.4 p -57.7 -13.65 4.38 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.154 -0.966 . . . . 0.0 110.742 -179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.86 13.4 28.83 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.025 -1.047 . . . . 0.0 110.699 -179.667 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.769 HD11 ' NE2' ' A' ' 65' ' ' GLN . 3.6 mt -92.06 -45.11 8.47 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.122 -0.986 . . . . 0.0 110.089 179.744 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.769 ' CE2' HG23 ' A' ' 31' ' ' VAL . 28.6 p90 -106.12 172.66 6.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.328 -0.857 . . . . 0.0 109.584 179.404 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.7 m -100.41 -35.52 9.54 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.864 -1.148 . . . . 0.0 110.99 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 119.84 2.93 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.091 -1.006 . . . . 0.0 110.81 -179.766 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.769 HG23 ' CE2' ' A' ' 28' ' ' TYR . 47.1 t -88.42 99.96 9.77 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.309 -0.869 . . . . 0.0 110.18 -179.958 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.775 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -62.12 151.28 36.14 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.289 -0.882 . . . . 0.0 111.663 -179.476 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.542 ' O ' HG23 ' A' ' 49' ' ' VAL . 0.3 OUTLIER -61.69 159.1 14.07 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.441 -0.787 . . . . 0.0 109.761 179.023 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.2 127.6 33.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 179.97 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.773 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 58.6 p-90 -146.39 120.63 9.55 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.085 -1.009 . . . . 0.0 110.634 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.631 ' CD2' ' N ' ' A' ' 37' ' ' TRP . 20.2 t60 -78.94 166.44 22.38 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.032 -1.043 . . . . 0.0 109.913 179.453 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.631 ' N ' ' CD2' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -78.41 50.7 0.96 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.159 -0.963 . . . . 0.0 110.039 179.817 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.445 ' C ' ' O ' ' B' ' 31' ' ' VAL . 13.0 t -150.83 165.49 33.41 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.303 -0.873 . . . . 0.0 110.149 179.868 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.453 ' O ' ' HB3' ' A' ' 40' ' ' HIS . . . -133.15 -170.17 12.37 Favored Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.721 -1.352 . . . . 0.0 109.721 -179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.453 ' HB3' ' O ' ' A' ' 39' ' ' GLY . 1.5 t-80 65.6 -131.3 0.24 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.38 -1.071 . . . . 0.0 110.196 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.4 t-20 -146.02 96.86 2.86 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 120.996 -1.065 . . . . 0.0 110.183 -179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 2.7 m -107.11 140.01 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.217 -0.927 . . . . 0.0 110.153 -179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 15.9 mttt -75.13 -25.19 58.25 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.234 -0.916 . . . . 0.0 110.215 -179.993 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 8.1 t60 -57.12 133.1 54.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.285 -0.884 . . . . 0.0 110.144 -179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 41.7 mttp -50.46 150.27 2.73 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.288 -0.882 . . . . 0.0 110.424 -179.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.557 ' HB2' ' CB ' ' A' ' 36' ' ' HIS . 0.0 OUTLIER -167.82 131.09 1.64 Allowed 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.224 -0.923 . . . . 0.0 110.106 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -164.43 108.23 0.93 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.218 -0.926 . . . . 0.0 110.567 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.622 HD11 ' HD2' ' A' ' 8' ' ' LYS . 80.1 mt -142.27 133.75 25.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.22 -0.925 . . . . 0.0 110.068 179.699 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.542 HG23 ' O ' ' A' ' 33' ' ' SER . 0.3 OUTLIER -125.14 -179.38 2.36 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 120.9 -1.125 . . . . 0.0 110.308 -179.932 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.415 ' N ' HG13 ' A' ' 49' ' ' VAL . 16.8 m -145.06 158.2 43.89 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.409 -0.807 . . . . 0.0 109.818 -179.89 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.494 HD23 ' HA ' ' A' ' 31' ' ' VAL . 27.0 mt -135.04 131.52 37.16 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.231 -0.918 . . . . 0.0 110.009 -179.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.463 HG23 ' CZ2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.83 130.56 44.08 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.309 -0.869 . . . . 0.0 110.263 -179.842 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.415 ' HB2' ' HG2' ' A' ' 3' ' ' PRO . 35.0 m-85 -117.8 152.86 34.48 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.387 -0.82 . . . . 0.0 109.986 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 98.7 m-20 -95.48 -18.35 20.74 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.362 -179.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 77.3 p -145.43 140.44 27.6 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.231 -0.918 . . . . 0.0 110.203 -179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -61.12 -39.58 90.55 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.18 -0.95 . . . . 0.0 110.226 -179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.9 t-105 -53.96 -50.45 66.48 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.292 -0.88 . . . . 0.0 110.286 179.985 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.423 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 60.2 tt0 -57.27 -40.1 77.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.253 -0.904 . . . . 0.0 110.424 -179.242 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -59.32 -38.99 81.7 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.128 -0.983 . . . . 0.0 110.168 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.833 ' HA ' HD12 ' A' ' 63' ' ' LEU . 42.6 m-20 -61.34 -41.42 97.01 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.315 -0.865 . . . . 0.0 110.53 -179.872 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.454 ' O ' ' OG ' ' A' ' 64' ' ' SER . 50.2 mt-30 -65.7 -40.08 91.91 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.159 -0.963 . . . . 0.0 110.201 -179.836 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.775 ' O ' HG22 ' A' ' 66' ' ' VAL . 68.3 t80 -55.76 -42.07 74.92 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.263 -0.898 . . . . 0.0 109.942 179.819 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.833 HD12 ' HA ' ' A' ' 60' ' ' ASP . 12.0 mt -59.44 -24.0 63.16 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.315 -0.866 . . . . 0.0 110.064 179.714 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.454 ' OG ' ' O ' ' A' ' 61' ' ' GLN . 3.7 p -100.08 -7.89 24.4 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.266 -0.896 . . . . 0.0 110.179 179.84 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.769 ' NE2' HD11 ' A' ' 27' ' ' LEU . 3.6 mt-30 -97.07 -29.31 13.7 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.314 -0.867 . . . . 0.0 109.818 179.746 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.784 ' O ' HG23 ' A' ' 66' ' ' VAL . 19.1 m -110.04 85.36 0.78 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 121.425 -0.797 . . . . 0.0 109.644 179.588 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.553 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -35.59 104.94 0.03 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.557 -0.715 . . . . 0.0 110.479 -179.517 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.519 HG13 ' O ' ' A' ' 66' ' ' VAL . 82.3 mt -87.67 115.03 61.61 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 121.176 -0.953 . . . . 0.0 110.467 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -63.4 -158.51 0.03 OUTLIER 'Trans proline' 0 C--N 1.304 -1.813 0 O-C-N 124.073 1.565 . . . . 0.0 110.082 179.657 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -106.54 -13.1 15.42 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.108 -0.995 . . . . 0.0 110.328 -179.857 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 30.2 p -84.59 -21.97 30.2 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.147 -0.971 . . . . 0.0 110.076 179.911 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.639 HD12 HD21 ' A' ' 14' ' ' LEU . 25.1 mm -93.75 108.34 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.285 -0.884 . . . . 0.0 109.858 179.67 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 81.7 m -96.14 153.72 17.64 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.192 -0.943 . . . . 0.0 110.241 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.663 ' CG1' HG13 ' A' ' 5' ' ' VAL . 6.9 t -145.26 156.17 13.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 121.228 -0.92 . . . . 0.0 110.717 -179.423 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 3.1 t -138.42 -179.07 5.58 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.51 -0.744 . . . . 0.0 110.061 -179.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.467 ' O ' ' HB3' ' B' ' 80' ' ' SER . 1.6 p -106.31 154.54 20.61 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.201 -0.937 . . . . 0.0 110.467 -179.672 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.433 ' C ' HG12 ' A' ' 4' ' ' ILE . . . -161.13 175.3 37.78 Favored Glycine 0 N--CA 1.49 2.286 0 N-CA-C 109.405 -1.478 . . . . 0.0 109.405 179.983 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.458 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 79.7 m-85 -147.92 137.88 22.68 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.182 -1.187 . . . . 0.0 110.44 -179.934 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 7.9 mtt -115.14 162.2 17.37 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.342 -0.849 . . . . 0.0 109.814 179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.444 ' O ' HG23 ' A' ' 81' ' ' ILE . 12.4 t -118.66 99.37 6.74 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.029 -1.044 . . . . 0.0 110.23 179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.444 HG23 ' O ' ' A' ' 80' ' ' SER . 1.7 pt . . . . . 0 N--CA 1.493 1.705 0 CA-C-O 118.021 -0.99 . . . . 0.0 110.248 179.935 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.448 ' HB3' ' HB3' ' B' ' 78' ' ' PHE . 0.8 OUTLIER . . . . . 0 N--CA 1.491 1.604 0 CA-C-O 121.213 0.53 . . . . 0.0 110.224 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.457 ' O ' HG23 ' B' ' 4' ' ' ILE . 63.6 p -96.77 106.5 30.72 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.204 -0.935 . . . . 0.0 110.308 -179.865 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.424 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 48.4 Cg_endo -52.54 155.96 9.3 Favored 'Trans proline' 0 C--N 1.305 -1.745 0 O-C-N 124.021 1.538 . . . . 0.0 110.302 179.902 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.457 HG23 ' O ' ' B' ' 2' ' ' THR . 7.6 pt -143.4 178.48 1.95 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.203 -0.936 . . . . 0.0 110.267 -180.0 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.665 HG13 ' CG1' ' B' ' 74' ' ' VAL . 39.8 t -145.64 136.04 18.74 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.294 -0.878 . . . . 0.0 110.257 -179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.556 ' O ' HG22 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.94 121.1 43.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.365 -0.834 . . . . 0.0 109.783 179.857 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.625 HD12 HG12 ' B' ' 5' ' ' VAL . 0.5 OUTLIER -115.08 124.23 51.03 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.175 -0.953 . . . . 0.0 110.57 -179.823 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.601 ' HD2' HD11 ' B' ' 48' ' ' ILE . 18.8 tttt -141.38 166.08 25.75 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.294 -0.879 . . . . 0.0 110.196 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.53 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 142.04 -146.3 17.21 Favored Glycine 0 N--CA 1.49 2.265 0 N-CA-C 109.741 -1.343 . . . . 0.0 109.741 -179.965 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -64.68 121.85 15.47 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.346 -1.091 . . . . 0.0 110.324 -179.823 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.71 -35.49 31.47 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 110.725 179.976 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -75.42 -43.59 49.05 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.175 -0.953 . . . . 0.0 110.561 -179.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 44.4 m -57.86 -28.18 63.9 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.173 -0.954 . . . . 0.0 110.403 -179.757 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.76 ' HA ' HD12 ' B' ' 17' ' ' LEU . 13.0 mt -81.9 -34.66 29.84 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.077 -1.015 . . . . 0.0 110.117 -179.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -59.74 -38.85 82.88 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.326 -0.859 . . . . 0.0 110.171 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.503 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 36.3 t -70.2 -37.71 75.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.313 -0.867 . . . . 0.0 110.485 -179.788 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.76 HD12 ' HA ' ' B' ' 14' ' ' LEU . 23.0 mt -58.76 -50.61 73.29 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.142 -0.974 . . . . 0.0 110.107 -179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 16.7 ttm105 -47.16 -28.65 1.91 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.423 -0.798 . . . . 0.0 110.433 179.846 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.503 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 72.0 t80 -64.84 -41.92 95.34 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.317 -0.864 . . . . 0.0 110.469 -179.778 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 26.2 mtt-85 -71.27 -26.42 62.87 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.0 110.364 -179.835 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.552 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.5 m-30 -66.64 -20.17 65.93 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.27 -0.894 . . . . 0.0 110.359 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 21.9 mmtp -63.38 -27.44 69.31 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.139 -0.976 . . . . 0.0 110.459 -179.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.3 mmtm -75.16 -48.32 24.18 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.264 -0.898 . . . . 0.0 110.512 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.423 ' CB ' HD12 ' B' ' 27' ' ' LEU . 18.9 m-70 -94.93 52.88 1.51 Allowed 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.249 -0.907 . . . . 0.0 110.22 -179.807 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 22.8 p -57.47 -13.72 3.99 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.29 -0.881 . . . . 0.0 110.558 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 2.1 p -96.96 13.58 28.42 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.128 -0.982 . . . . 0.0 110.817 -179.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.789 HD11 ' NE2' ' B' ' 65' ' ' GLN . 3.6 mt -92.32 -44.13 8.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.071 -1.018 . . . . 0.0 109.97 179.651 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.774 ' CE2' HG23 ' B' ' 31' ' ' VAL . 27.8 p90 -107.14 173.33 6.37 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.256 -0.903 . . . . 0.0 109.536 179.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.2 m -100.86 -35.79 9.29 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.054 -1.029 . . . . 0.0 110.919 -179.514 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.76 119.86 2.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.165 -0.959 . . . . 0.0 110.684 -179.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.774 HG23 ' CE2' ' B' ' 28' ' ' TYR . 48.5 t -88.19 99.68 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.187 -0.946 . . . . 0.0 110.089 -179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.773 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -60.78 150.13 33.54 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.317 -0.864 . . . . 0.0 111.485 -179.49 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . 0.576 ' O ' HG23 ' B' ' 49' ' ' VAL . 0.3 OUTLIER -61.7 159.65 13.1 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 121.551 -0.718 . . . . 0.0 109.575 179.107 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.405 ' HA ' HG23 ' B' ' 49' ' ' VAL . 0.5 OUTLIER -68.25 127.41 32.81 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.036 -1.04 . . . . 0.0 110.616 -179.955 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.775 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 58.4 p-90 -146.22 120.73 9.72 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.024 -1.047 . . . . 0.0 110.701 179.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.636 ' CD2' ' N ' ' B' ' 37' ' ' TRP . 20.9 t60 -78.86 166.48 22.38 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 120.933 -1.104 . . . . 0.0 109.902 179.581 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.636 ' N ' ' CD2' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -78.57 50.93 1.01 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.102 -0.998 . . . . 0.0 110.129 -179.922 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.441 ' C ' ' O ' ' A' ' 31' ' ' VAL . 13.6 t -150.71 169.95 20.38 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.32 -0.863 . . . . 0.0 110.184 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . 0.465 ' O ' ' HB3' ' B' ' 40' ' ' HIS . . . -137.09 -171.32 12.15 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.67 -1.372 . . . . 0.0 109.67 179.951 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . 0.465 ' HB3' ' O ' ' B' ' 39' ' ' GLY . 1.5 t-80 66.0 -131.79 0.21 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.285 -1.127 . . . . 0.0 110.18 -179.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -145.11 97.44 3.01 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 120.981 -1.074 . . . . 0.0 110.293 -179.797 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.7 m -107.71 140.64 25.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.278 -0.889 . . . . 0.0 109.912 179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 16.2 mttt -75.74 -25.33 56.46 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.184 -0.947 . . . . 0.0 110.184 -179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 8.3 t60 -56.48 132.59 51.77 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.207 -0.933 . . . . 0.0 110.228 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 42.3 mttp -50.22 150.33 2.52 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.293 -0.88 . . . . 0.0 110.297 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.527 ' HB2' ' CB ' ' B' ' 36' ' ' HIS . 0.0 OUTLIER -167.62 132.88 1.94 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.335 -0.853 . . . . 0.0 110.095 179.829 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -166.38 108.61 0.72 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.164 -0.96 . . . . 0.0 110.583 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.601 HD11 ' HD2' ' B' ' 8' ' ' LYS . 85.3 mt -142.38 134.23 26.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.326 -0.859 . . . . 0.0 109.799 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.576 HG23 ' O ' ' B' ' 33' ' ' SER . 0.3 OUTLIER -125.91 -179.4 2.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 120.841 -1.162 . . . . 0.0 110.306 -179.785 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.401 ' N ' HG13 ' B' ' 49' ' ' VAL . 17.1 m -145.03 158.43 43.82 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.318 -0.863 . . . . 0.0 109.97 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' B' ' 31' ' ' VAL . 25.2 mt -134.97 131.44 37.18 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.23 -0.919 . . . . 0.0 109.982 179.954 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.569 HG23 ' CZ2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.62 130.77 43.76 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.313 -0.867 . . . . 0.0 110.167 -179.912 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.424 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 35.5 m-85 -118.07 153.3 33.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.346 -0.846 . . . . 0.0 110.003 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 98.3 m-20 -95.4 -18.49 20.69 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.25 -0.906 . . . . 0.0 110.397 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 p -145.32 140.33 27.66 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.152 -0.967 . . . . 0.0 110.307 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -61.1 -39.3 89.45 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.288 -0.883 . . . . 0.0 110.044 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.3 t-105 -54.12 -50.99 65.64 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.232 -0.917 . . . . 0.0 110.237 179.947 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.425 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 60.9 tt0 -57.08 -39.7 75.5 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.276 -0.89 . . . . 0.0 110.409 -179.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 tmm_? -59.69 -38.86 82.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.085 -1.009 . . . . 0.0 110.006 179.685 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.859 ' HA ' HD12 ' B' ' 63' ' ' LEU . 43.4 m-20 -61.44 -41.31 97.0 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.416 -0.803 . . . . 0.0 110.441 -179.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.448 ' O ' ' OG ' ' B' ' 64' ' ' SER . 52.0 mt-30 -65.83 -40.0 91.39 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.252 -0.905 . . . . 0.0 110.283 -179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.798 ' O ' HG22 ' B' ' 66' ' ' VAL . 69.5 t80 -55.83 -41.68 74.6 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 109.754 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.859 HD12 ' HA ' ' B' ' 60' ' ' ASP . 13.0 mt -59.51 -24.58 63.76 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.336 -0.852 . . . . 0.0 110.049 179.759 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.448 ' OG ' ' O ' ' B' ' 61' ' ' GLN . 3.9 p -99.87 -7.9 24.73 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.299 -0.876 . . . . 0.0 110.144 179.995 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . 0.789 ' NE2' HD11 ' B' ' 27' ' ' LEU . 3.5 mt-30 -97.08 -29.13 13.81 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.303 -0.873 . . . . 0.0 109.881 179.739 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.798 HG22 ' O ' ' B' ' 62' ' ' PHE . 20.3 m -110.0 83.58 0.68 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.661 0 O-C-N 121.323 -0.861 . . . . 0.0 109.912 179.704 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.55 ' O ' ' CG ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -33.47 104.14 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.497 -0.752 . . . . 0.0 110.627 -179.816 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.508 HG13 ' O ' ' B' ' 66' ' ' VAL . 84.8 mt -87.89 114.49 59.38 Favored Pre-proline 0 N--CA 1.492 1.638 0 O-C-N 121.268 -0.895 . . . . 0.0 110.534 -179.337 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 44.8 Cg_endo -62.75 -159.03 0.03 OUTLIER 'Trans proline' 0 C--N 1.303 -1.845 0 O-C-N 124.211 1.637 . . . . 0.0 110.236 179.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -106.24 -12.84 15.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.184 -0.948 . . . . 0.0 110.492 -179.916 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 29.9 p -84.69 -21.97 29.97 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.161 -0.962 . . . . 0.0 110.13 179.893 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.641 HD12 HD21 ' B' ' 14' ' ' LEU . 24.8 mm -94.12 108.5 20.72 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 O-C-N 121.287 -0.883 . . . . 0.0 109.751 179.702 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 85.1 m -96.09 153.64 17.68 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.109 -0.995 . . . . 0.0 110.07 179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.665 ' CG1' HG13 ' B' ' 5' ' ' VAL . 6.0 t -144.99 155.98 13.98 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.107 -0.995 . . . . 0.0 110.546 -179.417 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 3.3 t -138.6 -178.92 5.52 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.504 -0.748 . . . . 0.0 110.154 -179.461 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.3 p -106.15 154.04 21.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.306 -0.871 . . . . 0.0 110.592 -179.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.448 ' C ' HG12 ' B' ' 4' ' ' ILE . . . -160.75 174.91 37.47 Favored Glycine 0 N--CA 1.491 2.304 0 N-CA-C 109.359 -1.496 . . . . 0.0 109.359 179.938 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.448 ' HB3' ' HB3' ' B' ' 1' ' ' MET . 80.1 m-85 -147.99 138.07 22.7 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.212 -1.169 . . . . 0.0 110.416 179.959 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 7.7 mtt -115.3 161.69 18.14 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.208 -0.933 . . . . 0.0 109.935 179.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.467 ' HB3' ' O ' ' A' ' 76' ' ' THR . 13.1 t -118.37 98.95 6.53 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 121.184 -0.948 . . . . 0.0 110.168 179.914 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.445 HG23 ' O ' ' B' ' 80' ' ' SER . 1.6 pt . . . . . 0 N--CA 1.492 1.643 0 CA-C-O 118.041 -0.981 . . . . 0.0 110.069 179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 10.7 mtp . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 121.253 0.549 . . . . 0.0 110.291 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.658 ' O ' HG23 ' A' ' 2' ' ' THR . 5.5 t -100.95 103.83 27.81 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 121.274 -0.891 . . . . 0.0 110.419 -179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 48.8 Cg_endo -49.33 157.94 1.83 Allowed 'Trans proline' 0 C--N 1.305 -1.763 0 O-C-N 124.009 1.531 . . . . 0.0 110.238 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.698 ' O ' HD12 ' A' ' 4' ' ' ILE . 2.3 pp -143.91 119.02 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.131 -0.981 . . . . 0.0 110.488 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.455 HG13 ' CG2' ' A' ' 74' ' ' VAL . 1.2 t -94.08 136.57 25.17 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.226 -0.921 . . . . 0.0 110.257 -179.909 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.525 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -105.47 138.62 41.37 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.301 -0.874 . . . . 0.0 109.695 179.529 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.584 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.3 OUTLIER -129.57 131.13 46.45 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 120.958 -1.089 . . . . 0.0 110.569 -179.55 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.473 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 14.4 ttpp -141.52 167.02 23.17 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.29 -0.881 . . . . 0.0 109.951 179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.474 ' O ' ' HB3' ' A' ' 46' ' ' SER . . . 145.6 -151.06 23.31 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.781 -1.327 . . . . 0.0 109.781 -179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.421 ' O ' ' HB ' ' A' ' 13' ' ' THR . 8.3 m-20 -65.33 127.22 30.88 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.317 -1.108 . . . . 0.0 110.715 -179.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.62 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.32 -68.81 0.14 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.318 -0.864 . . . . 0.0 110.398 179.797 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 9.9 p30 -46.0 -43.61 14.4 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.132 -0.98 . . . . 0.0 110.177 -179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.485 HG22 HD11 ' A' ' 72' ' ' ILE . 22.3 m -57.94 -18.25 22.19 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.0 110.104 179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.947 ' HA ' HD12 ' A' ' 17' ' ' LEU . 19.7 mt -91.53 -29.88 16.73 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.306 -0.871 . . . . 0.0 110.442 -179.847 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.0 mmtt -59.03 -41.43 87.77 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.204 -0.935 . . . . 0.0 110.481 -179.678 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 9.5 t -69.74 -36.49 75.89 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.381 -0.824 . . . . 0.0 110.547 -179.651 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.947 HD12 ' HA ' ' A' ' 14' ' ' LEU . 46.0 mt -58.92 -54.49 46.55 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.04 -1.038 . . . . 0.0 110.36 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -45.81 -32.1 2.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.341 -0.849 . . . . 0.0 110.307 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 39.6 t80 -64.82 -29.34 70.29 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.215 -0.928 . . . . 0.0 110.213 -179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.7 mtt180 -69.87 -21.8 63.3 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.141 -0.974 . . . . 0.0 110.025 179.896 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.708 ' CE2' HD21 ' A' ' 51' ' ' LEU . 10.2 m-30 -66.47 -36.41 82.68 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.317 -0.864 . . . . 0.0 110.045 179.863 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 34.4 mmtm -63.61 -33.79 76.4 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.429 -0.795 . . . . 0.0 110.218 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.8 mmmm -74.96 -9.43 58.53 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.207 -0.933 . . . . 0.0 109.863 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.551 ' HB3' HD12 ' A' ' 27' ' ' LEU . 99.1 m-70 -145.04 43.53 1.33 Allowed 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.326 -0.859 . . . . 0.0 109.831 179.739 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.485 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.8 t -57.74 -8.58 0.95 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.421 -0.8 . . . . 0.0 111.039 -179.743 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 70.6 p -95.78 7.69 45.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 120.93 -1.106 . . . . 0.0 110.292 -179.755 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.551 HD12 ' HB3' ' A' ' 24' ' ' HIS . 5.0 mt -92.33 -54.87 3.63 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.216 -0.928 . . . . 0.0 109.864 179.5 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.639 ' CD1' HG13 ' A' ' 31' ' ' VAL . 31.7 p90 -93.65 169.84 10.02 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.244 -0.91 . . . . 0.0 109.787 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 5.1 m -100.61 -33.24 10.38 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.081 -1.012 . . . . 0.0 110.811 -179.802 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.49 114.7 2.44 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.959 -1.088 . . . . 0.0 110.748 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.68 HG12 ' CD2' ' A' ' 51' ' ' LEU . 20.5 m -90.57 112.9 25.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 110.187 179.364 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.568 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.5 OUTLIER -68.45 147.94 51.34 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.157 -0.964 . . . . 0.0 110.342 -179.931 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.485 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -61.5 159.64 12.56 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.266 -0.896 . . . . 0.0 110.21 179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.895 ' HA ' HG23 ' A' ' 49' ' ' VAL . 91.7 m -68.18 134.86 51.16 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.356 -0.84 . . . . 0.0 110.447 179.924 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.59 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 60.2 p-90 -146.66 -178.39 6.15 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.233 -0.917 . . . . 0.0 109.564 179.595 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.576 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 70.6 t60 -162.43 174.23 13.0 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.893 -1.129 . . . . 0.0 110.66 -179.392 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.576 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 74.7 m95 -78.65 103.41 8.58 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.274 -0.891 . . . . 0.0 110.281 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.448 ' O ' HG23 ' B' ' 31' ' ' VAL . 3.0 p -117.79 -179.49 3.76 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.349 -0.844 . . . . 0.0 110.217 179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -174.2 -89.35 0.07 OUTLIER Glycine 0 N--CA 1.49 2.277 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 179.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -138.66 -62.9 0.55 Allowed 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.432 -1.04 . . . . 0.0 110.127 -179.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.4 m120 -102.49 99.97 10.04 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.268 -0.895 . . . . 0.0 110.185 179.919 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 27.0 m -136.15 144.63 32.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.268 -0.895 . . . . 0.0 110.187 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 13.6 mtpt -94.14 -91.66 0.19 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 110.292 -179.85 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.541 ' CG ' ' O ' ' A' ' 44' ' ' HIS . 31.0 p-80 -149.36 120.27 7.64 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.189 -0.945 . . . . 0.0 110.132 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.408 ' HB2' ' CE1' ' A' ' 36' ' ' HIS . 69.8 mmtt -118.73 -123.38 0.29 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.217 -0.927 . . . . 0.0 110.344 -179.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.474 ' HB3' ' O ' ' A' ' 9' ' ' GLY . 0.1 OUTLIER -146.18 108.13 4.36 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.027 -1.046 . . . . 0.0 110.573 -179.747 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.507 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . -39.16 157.51 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.492 -0.755 . . . . 0.0 110.567 -179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.584 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.9 mt -143.85 148.48 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.522 0 O-C-N 121.41 -0.806 . . . . 0.0 109.939 -179.814 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.895 HG23 ' HA ' ' A' ' 34' ' ' THR . 0.4 OUTLIER -128.16 -179.48 2.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.1 -1.0 . . . . 0.0 110.276 -179.899 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.566 ' N ' HG13 ' A' ' 49' ' ' VAL . 96.4 m -145.98 154.05 41.47 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.256 -0.903 . . . . 0.0 110.009 -179.908 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.708 HD21 ' CE2' ' A' ' 21' ' ' PHE . 17.7 mt -132.91 124.09 27.19 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.148 -0.97 . . . . 0.0 110.24 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.35 132.88 42.65 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.28 -0.887 . . . . 0.0 110.263 179.937 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 45.0 m-85 -117.73 153.87 32.66 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.298 -0.876 . . . . 0.0 110.188 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -85.25 -9.99 57.08 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.289 -0.882 . . . . 0.0 110.574 -179.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 4.0 m -162.46 160.43 26.24 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.135 -0.978 . . . . 0.0 110.238 179.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 77.1 mt-10 -70.99 -37.85 72.71 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.213 -0.929 . . . . 0.0 110.18 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 27.7 t-105 -53.97 -52.38 60.87 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.184 -0.948 . . . . 0.0 110.223 -179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.509 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 21.5 tt0 -58.08 -36.03 72.26 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.335 -0.853 . . . . 0.0 110.624 -179.552 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 12.8 ttp85 -59.13 -54.13 50.46 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.101 -0.999 . . . . 0.0 110.601 -179.852 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.551 ' HA ' HD12 ' A' ' 63' ' ' LEU . 2.2 t70 -61.05 -26.34 67.56 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.201 -0.937 . . . . 0.0 110.364 -179.661 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 46.7 mt-30 -65.54 -54.89 21.71 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.207 -0.933 . . . . 0.0 109.785 179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 1.067 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.8 t80 -55.63 -39.74 71.23 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.253 -0.905 . . . . 0.0 109.832 179.555 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.551 HD12 ' HA ' ' A' ' 60' ' ' ASP . 9.2 mt -59.19 -23.64 62.42 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.26 -0.9 . . . . 0.0 110.068 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.71 -18.69 21.06 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.31 -0.869 . . . . 0.0 110.149 179.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.0 mm100 -93.93 -9.05 38.37 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.178 -0.951 . . . . 0.0 109.89 -179.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 1.067 HG22 ' O ' ' A' ' 62' ' ' PHE . 34.0 m -136.41 133.09 49.44 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.546 0 O-C-N 121.367 -0.833 . . . . 0.0 109.811 179.564 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.77 103.08 11.08 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.241 -0.912 . . . . 0.0 109.785 179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.722 ' CG2' HD12 ' A' ' 72' ' ' ILE . 18.1 mt -88.08 130.94 44.4 Favored Pre-proline 0 N--CA 1.491 1.588 0 O-C-N 121.437 -0.789 . . . . 0.0 110.336 -179.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.55 ' HD2' ' CG2' ' A' ' 68' ' ' ILE . 41.6 Cg_endo -40.53 162.34 0.03 OUTLIER 'Trans proline' 0 C--N 1.307 -1.639 0 O-C-N 123.969 1.51 . . . . 0.0 110.463 179.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 11.1 mttt -74.99 3.35 8.5 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.298 -0.876 . . . . 0.0 110.882 -179.374 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.68 -24.87 28.79 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.043 -1.035 . . . . 0.0 109.842 179.723 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.722 HD12 ' CG2' ' A' ' 68' ' ' ILE . 81.2 mt -95.41 109.11 21.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.7 0 O-C-N 121.51 -0.743 . . . . 0.0 110.503 179.873 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 79.4 m -96.14 157.0 16.1 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.219 -0.926 . . . . 0.0 110.451 179.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.525 HG23 ' O ' ' A' ' 6' ' ' HIS . 3.4 p -143.07 136.43 25.77 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.106 -0.996 . . . . 0.0 111.409 -179.086 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -102.23 -179.53 4.02 Favored 'General case' 0 N--CA 1.491 1.575 0 CA-C-O 121.294 0.568 . . . . 0.0 110.141 179.799 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 50.2 p -128.94 154.33 46.66 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.306 -0.871 . . . . 0.0 109.96 179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.414 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -171.54 -170.33 35.46 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.843 -1.303 . . . . 0.0 109.843 -179.778 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.414 ' CD1' ' O ' ' A' ' 77' ' ' GLY . 56.2 m-85 -147.53 150.63 34.88 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.355 -1.085 . . . . 0.0 110.32 179.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 1.1 ttt -124.61 167.61 14.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.235 -0.915 . . . . 0.0 109.989 179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 27.4 t -131.47 103.68 6.56 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.0 110.309 -179.807 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.603 ' O ' HG23 ' A' ' 81' ' ' ILE . 6.5 tt . . . . . 0 N--CA 1.49 1.56 0 CA-C-O 118.095 -0.955 . . . . 0.0 110.257 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 9.9 mtp . . . . . 0 N--CA 1.493 1.691 0 CA-C-O 121.247 0.546 . . . . 0.0 110.178 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.652 ' O ' HG23 ' B' ' 2' ' ' THR . 5.4 t -101.31 104.46 33.47 Favored Pre-proline 0 N--CA 1.492 1.643 0 O-C-N 121.286 -0.884 . . . . 0.0 110.401 -179.883 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.525 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -50.16 157.63 2.86 Favored 'Trans proline' 0 C--N 1.304 -1.796 0 O-C-N 123.974 1.513 . . . . 0.0 110.114 179.829 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.683 ' O ' HD12 ' B' ' 4' ' ' ILE . 2.3 pp -143.87 119.05 4.11 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 O-C-N 121.217 -0.927 . . . . 0.0 110.325 -179.75 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.437 HG13 ' CG2' ' B' ' 74' ' ' VAL . 1.1 t -94.11 136.11 26.53 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.561 0 O-C-N 121.262 -0.899 . . . . 0.0 110.301 -179.922 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.503 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -105.2 138.57 41.19 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.29 -0.881 . . . . 0.0 109.666 179.653 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.608 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.3 OUTLIER -129.77 131.4 46.22 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.004 -1.06 . . . . 0.0 110.607 -179.484 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.477 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 15.0 ttpp -141.43 167.17 22.8 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.173 -0.954 . . . . 0.0 109.983 179.679 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.473 ' O ' ' HB3' ' B' ' 46' ' ' SER . . . 145.66 -151.53 23.72 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.916 -1.274 . . . . 0.0 109.916 -179.885 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . 0.411 ' O ' ' HB ' ' B' ' 13' ' ' THR . 9.6 m-20 -64.93 127.25 30.79 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.275 -1.132 . . . . 0.0 110.655 -179.862 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.635 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.34 -68.99 0.13 Allowed 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.275 -0.89 . . . . 0.0 110.282 179.819 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . 0.411 ' OD1' ' N ' ' B' ' 13' ' ' THR . 10.3 p30 -45.71 -43.93 13.2 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.273 -0.892 . . . . 0.0 110.187 -179.964 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.496 HG22 HD11 ' B' ' 72' ' ' ILE . 22.2 m -57.83 -18.02 19.68 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.289 -0.882 . . . . 0.0 110.096 179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.946 ' HA ' HD12 ' B' ' 17' ' ' LEU . 18.6 mt -91.74 -29.63 16.7 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.254 -0.904 . . . . 0.0 110.337 -179.828 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.5 mmtt -59.17 -41.17 87.8 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.331 -0.856 . . . . 0.0 110.519 -179.718 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 15.8 t -69.96 -36.56 75.35 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.368 -0.832 . . . . 0.0 110.564 -179.575 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.946 HD12 ' HA ' ' B' ' 14' ' ' LEU . 44.4 mt -59.04 -54.12 50.68 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.115 -0.991 . . . . 0.0 110.495 -179.806 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 49.6 ttp180 -46.08 -31.99 2.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.36 -0.838 . . . . 0.0 110.332 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 38.8 t80 -64.89 -29.85 70.81 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.161 -0.962 . . . . 0.0 110.081 -179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 45.3 mtt180 -69.6 -21.95 63.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.262 -0.899 . . . . 0.0 110.008 179.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.7 ' CE2' HD21 ' B' ' 51' ' ' LEU . 10.2 m-30 -66.48 -36.3 82.41 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.26 -0.9 . . . . 0.0 109.87 179.65 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 34.7 mmtm -63.71 -34.0 76.9 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.377 -0.827 . . . . 0.0 110.222 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 2.1 mmmm -74.88 -9.3 58.41 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.161 -0.962 . . . . 0.0 109.753 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.535 ' HB3' HD12 ' B' ' 27' ' ' LEU . 99.0 m-70 -145.16 43.66 1.32 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.379 -0.826 . . . . 0.0 109.948 179.749 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.467 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.8 t -57.73 -8.9 1.02 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.341 -0.849 . . . . 0.0 111.136 -179.717 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 68.9 p -95.38 7.62 45.64 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.959 -1.088 . . . . 0.0 110.327 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.535 HD12 ' HB3' ' B' ' 24' ' ' HIS . 5.0 mt -92.41 -54.49 3.78 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.223 -0.923 . . . . 0.0 109.878 179.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.65 ' CD1' HG13 ' B' ' 31' ' ' VAL . 31.6 p90 -93.7 169.46 10.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.273 -0.892 . . . . 0.0 109.779 179.639 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 5.5 m -100.53 -33.15 10.44 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.116 -0.99 . . . . 0.0 110.815 -179.694 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.44 114.55 2.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.1 -1.0 . . . . 0.0 110.843 -179.789 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.688 HG12 ' CD2' ' B' ' 51' ' ' LEU . 17.0 m -90.6 111.63 23.79 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.405 -0.809 . . . . 0.0 110.119 179.455 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.59 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.5 OUTLIER -67.6 148.33 51.54 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.11 -0.994 . . . . 0.0 110.502 -179.714 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . 0.471 ' HB3' ' O ' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -61.6 158.96 14.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.344 -0.847 . . . . 0.0 110.245 179.909 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.883 ' HA ' HG23 ' B' ' 49' ' ' VAL . 86.1 m -68.18 134.9 51.22 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.317 -0.864 . . . . 0.0 110.602 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.568 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 59.5 p-90 -146.75 -178.17 6.04 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.34 -0.85 . . . . 0.0 109.549 179.521 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.583 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 70.4 t60 -162.35 174.44 12.79 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.828 -1.17 . . . . 0.0 110.685 -179.404 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.583 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 73.5 m95 -78.54 103.57 8.57 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.225 -0.922 . . . . 0.0 110.183 -179.654 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.486 ' O ' HG23 ' A' ' 31' ' ' VAL . 3.0 p -118.28 -179.81 3.89 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.268 -0.895 . . . . 0.0 110.167 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -173.95 -89.67 0.08 OUTLIER Glycine 0 N--CA 1.49 2.234 0 N-CA-C 109.495 -1.442 . . . . 0.0 109.495 179.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 10.0 t60 -138.17 -62.82 0.57 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.334 -1.098 . . . . 0.0 110.163 179.887 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 36.5 m120 -102.56 99.55 9.57 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.216 -0.928 . . . . 0.0 110.154 179.974 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 28.3 m -135.59 143.85 35.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.259 -0.901 . . . . 0.0 110.128 179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 13.5 mtpt -93.36 -92.51 0.17 Allowed 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.364 -0.835 . . . . 0.0 110.078 179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . 0.518 ' CG ' ' O ' ' B' ' 44' ' ' HIS . 31.9 p-80 -148.28 122.03 9.28 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.087 -1.008 . . . . 0.0 110.111 179.929 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -120.09 -122.37 0.29 Allowed 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.227 -0.921 . . . . 0.0 110.429 -179.827 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.473 ' HB3' ' O ' ' B' ' 9' ' ' GLY . 0.1 OUTLIER -147.02 107.64 4.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.993 -1.067 . . . . 0.0 110.641 -179.811 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.519 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . . . -39.0 157.31 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.415 -0.803 . . . . 0.0 110.44 179.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.608 HG23 ' O ' ' B' ' 7' ' ' LEU . 44.5 mt -143.93 148.22 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.342 -0.849 . . . . 0.0 110.024 -179.858 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.883 HG23 ' HA ' ' B' ' 34' ' ' THR . 0.4 OUTLIER -127.47 -179.33 2.74 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.134 -0.979 . . . . 0.0 110.193 -179.925 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.585 ' N ' HG13 ' B' ' 49' ' ' VAL . 93.4 m -145.73 154.27 41.87 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.232 -0.918 . . . . 0.0 109.872 -179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.7 HD21 ' CE2' ' B' ' 21' ' ' PHE . 18.9 mt -133.14 123.53 25.84 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.052 -1.03 . . . . 0.0 110.207 -179.781 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.12 133.69 41.44 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.296 -0.877 . . . . 0.0 110.201 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.525 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 44.2 m-85 -118.91 154.41 33.02 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.275 -0.891 . . . . 0.0 110.226 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -85.09 -10.66 56.6 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.34 -0.85 . . . . 0.0 110.522 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.3 m -162.16 160.71 27.51 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.08 -1.012 . . . . 0.0 110.434 -179.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 78.5 mt-10 -70.72 -38.81 73.62 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.302 -0.874 . . . . 0.0 110.238 179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 28.6 t-105 -53.63 -52.18 60.7 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.252 -0.905 . . . . 0.0 110.229 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.482 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 21.9 tt0 -58.25 -35.93 72.46 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.198 -0.939 . . . . 0.0 110.602 -179.528 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 13.2 ttp85 -59.19 -54.33 48.21 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.054 -1.028 . . . . 0.0 110.68 -179.864 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.538 ' HA ' HD12 ' B' ' 63' ' ' LEU . 2.5 t70 -61.0 -26.1 67.35 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.179 -0.951 . . . . 0.0 110.295 -179.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.465 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 45.3 mt-30 -65.54 -54.89 21.64 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.22 -0.925 . . . . 0.0 109.915 179.731 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 1.046 ' O ' HG22 ' B' ' 66' ' ' VAL . 1.7 t80 -55.67 -39.95 71.63 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.263 -0.898 . . . . 0.0 109.833 179.532 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.538 HD12 ' HA ' ' B' ' 60' ' ' ASP . 9.0 mt -59.19 -23.61 62.39 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.3 -0.875 . . . . 0.0 110.044 -179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -94.22 -18.95 21.18 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.217 -0.927 . . . . 0.0 110.362 179.92 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 2.8 mm100 -94.43 -8.34 38.88 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.209 -0.932 . . . . 0.0 110.042 -179.556 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 1.046 HG22 ' O ' ' B' ' 62' ' ' PHE . 33.6 m -136.7 132.79 48.39 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.362 -0.836 . . . . 0.0 109.676 179.512 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.19 103.05 11.19 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.346 -0.846 . . . . 0.0 109.793 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.679 ' CG2' HD12 ' B' ' 72' ' ' ILE . 18.2 mt -87.98 130.67 45.61 Favored Pre-proline 0 N--CA 1.491 1.609 0 O-C-N 121.297 -0.877 . . . . 0.0 110.215 -179.47 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.55 ' HD2' ' CG2' ' B' ' 68' ' ' ILE . 40.7 Cg_endo -40.56 163.14 0.02 OUTLIER 'Trans proline' 0 C--N 1.308 -1.6 0 O-C-N 123.889 1.468 . . . . 0.0 110.501 179.874 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 11.6 mttt -75.47 3.03 10.03 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.334 -0.854 . . . . 0.0 111.008 -179.338 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.56 -24.83 29.08 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.052 -1.03 . . . . 0.0 109.902 179.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.679 HD12 ' CG2' ' B' ' 68' ' ' ILE . 84.4 mt -95.55 108.6 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.363 -0.836 . . . . 0.0 110.417 179.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 89.9 m -95.83 157.31 15.95 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.285 -0.884 . . . . 0.0 110.41 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.503 HG23 ' O ' ' B' ' 6' ' ' HIS . 3.2 p -143.29 137.37 25.9 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.131 -0.981 . . . . 0.0 111.539 -179.003 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -103.22 -179.4 3.94 Favored 'General case' 0 N--CA 1.491 1.603 0 CA-C-O 121.343 0.592 . . . . 0.0 110.167 179.588 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 46.5 p -128.83 154.37 46.51 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.242 -0.911 . . . . 0.0 109.929 179.728 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.419 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -171.72 -170.16 35.39 Favored Glycine 0 N--CA 1.492 2.402 0 N-CA-C 109.798 -1.321 . . . . 0.0 109.798 -179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.419 ' CD1' ' O ' ' B' ' 77' ' ' GLY . 57.7 m-85 -147.58 151.25 35.94 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.33 -1.1 . . . . 0.0 110.284 -179.982 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -125.16 167.14 15.23 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.264 -0.898 . . . . 0.0 109.982 179.774 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 27.3 t -131.06 103.95 6.82 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.097 -1.002 . . . . 0.0 110.284 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.619 HG23 ' O ' ' B' ' 81' ' ' ILE . 6.7 tt . . . . . 0 N--CA 1.49 1.528 0 CA-C-O 118.042 -0.98 . . . . 0.0 110.232 179.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 2.2 mtp . . . . . 0 N--CA 1.492 1.648 0 CA-C-O 121.31 0.576 . . . . 0.0 110.221 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.72 ' O ' HG23 ' A' ' 2' ' ' THR . 15.1 t -92.0 113.78 60.04 Favored Pre-proline 0 N--CA 1.491 1.618 0 O-C-N 121.206 -0.934 . . . . 0.0 109.978 179.767 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.502 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.0 Cg_endo -62.55 160.33 32.54 Favored 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 123.894 1.47 . . . . 0.0 110.281 -179.727 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.436 HG21 ' SD ' ' A' ' 79' ' ' MET . 1.0 OUTLIER -143.29 122.37 8.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.372 -0.83 . . . . 0.0 109.939 179.736 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.72 HG13 ' CG2' ' A' ' 74' ' ' VAL . 85.5 t -94.28 130.08 43.67 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.566 0 O-C-N 121.2 -0.937 . . . . 0.0 110.616 -179.57 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.546 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -105.83 122.22 45.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.245 -0.909 . . . . 0.0 109.729 179.48 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.533 ' HG ' ' CG2' ' A' ' 72' ' ' ILE . 0.7 OUTLIER -115.67 135.97 53.52 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 0.0 110.792 -179.35 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.492 ' O ' ' HA ' ' A' ' 72' ' ' ILE . 4.3 ttpp -140.65 166.18 25.44 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.216 -0.928 . . . . 0.0 109.834 179.894 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.466 ' O ' ' HB2' ' A' ' 46' ' ' SER . . . 150.9 -156.14 26.52 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 32.8 m-20 -64.97 130.66 44.18 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.344 -1.092 . . . . 0.0 110.666 -179.797 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.517 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.54 -63.1 1.23 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.301 -0.874 . . . . 0.0 110.551 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.4 p30 -44.87 -47.29 11.14 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.073 -1.017 . . . . 0.0 110.58 -179.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.449 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 97.0 m -57.77 -30.52 65.71 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.16 -0.963 . . . . 0.0 110.545 -179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.968 ' HA ' HD12 ' A' ' 17' ' ' LEU . 6.8 mt -70.59 -33.51 71.15 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.17 -0.956 . . . . 0.0 110.263 -179.954 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.51 -44.14 93.22 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.237 -0.914 . . . . 0.0 110.753 -179.59 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.461 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 21.5 t -69.82 -38.24 76.51 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.246 -0.909 . . . . 0.0 110.856 -179.356 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.968 HD12 ' HA ' ' A' ' 14' ' ' LEU . 21.6 mt -58.81 -56.19 25.38 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.219 -0.926 . . . . 0.0 110.561 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 59.7 ttp180 -45.95 -28.22 1.09 Allowed 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.226 -0.921 . . . . 0.0 110.29 -179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.461 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 61.0 t80 -64.82 -31.12 72.2 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.176 -0.953 . . . . 0.0 109.903 179.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 94.1 mtt180 -67.61 -21.77 65.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.317 -0.864 . . . . 0.0 110.07 179.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.493 ' CE2' HD21 ' A' ' 51' ' ' LEU . 10.2 m-30 -66.25 -36.43 82.99 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.227 -0.921 . . . . 0.0 110.026 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 31.2 mmtm -63.52 -41.0 98.51 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.277 -0.889 . . . . 0.0 110.031 179.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.06 -2.09 25.87 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.188 -0.945 . . . . 0.0 109.847 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.487 ' HB3' HD12 ' A' ' 27' ' ' LEU . 84.8 m-70 -144.69 35.48 1.16 Allowed 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.412 -0.805 . . . . 0.0 109.351 179.607 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.524 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 1.6 t -57.55 -9.41 1.12 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.576 -0.702 . . . . 0.0 111.054 -179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 69.4 p -95.51 4.9 52.77 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.986 -1.071 . . . . 0.0 110.411 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.507 ' HA ' HD23 ' A' ' 27' ' ' LEU . 8.8 mt -92.59 -48.78 6.44 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.161 -0.962 . . . . 0.0 110.171 179.651 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.524 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 10.2 p90 -100.67 165.78 11.22 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.141 -0.974 . . . . 0.0 109.755 179.736 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 7.1 m -101.33 -30.32 11.55 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.93 -1.106 . . . . 0.0 110.887 -179.814 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.3 111.38 2.13 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.048 -1.033 . . . . 0.0 110.899 -179.512 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.47 HG12 HD23 ' A' ' 51' ' ' LEU . 31.9 m -90.58 140.63 15.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.27 -0.894 . . . . 0.0 110.02 179.242 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.6 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 0.0 OUTLIER -90.89 145.56 24.64 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.232 -0.917 . . . . 0.0 110.316 -179.916 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 162.12 8.5 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.247 -0.908 . . . . 0.0 110.43 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 17.5 m -68.32 132.5 47.19 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.276 -0.89 . . . . 0.0 110.475 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.622 ' CZ3' ' HB3' ' B' ' 32' ' ' SER . 55.5 p-90 -146.81 -178.33 6.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.262 -0.899 . . . . 0.0 109.826 179.69 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.638 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 25.6 t60 -162.35 174.43 12.79 Favored 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.001 -1.062 . . . . 0.0 110.719 -179.543 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.638 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 34.4 m95 -78.57 98.28 6.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.519 -0.738 . . . . 0.0 110.024 -179.935 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 32.8 p -114.52 -178.46 3.38 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.204 -0.935 . . . . 0.0 110.225 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -177.28 -103.87 0.17 Allowed Glycine 0 N--CA 1.491 2.312 0 N-CA-C 109.261 -1.536 . . . . 0.0 109.261 -179.992 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 9.1 t60 -117.22 -64.8 1.26 Allowed 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.299 -1.118 . . . . 0.0 110.213 179.744 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -98.82 98.72 9.78 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.208 -0.933 . . . . 0.0 110.119 179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 42' ' ' VAL . 9.2 m -133.46 116.1 24.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 121.156 -0.965 . . . . 0.0 110.424 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 20.1 mtpt -69.94 -80.14 0.05 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.234 -0.916 . . . . 0.0 109.93 179.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.575 ' CG ' ' O ' ' A' ' 44' ' ' HIS . 40.5 p-80 -165.4 119.7 1.25 Allowed 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.363 -0.836 . . . . 0.0 109.929 179.571 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.616 ' HB2' ' CE1' ' A' ' 36' ' ' HIS . 15.4 mmtt -114.55 -133.37 0.34 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.281 -0.887 . . . . 0.0 110.352 -179.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.466 ' HB2' ' O ' ' A' ' 9' ' ' GLY . 77.9 p -131.04 106.98 8.74 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.175 -0.953 . . . . 0.0 110.62 -179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.506 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . . . -40.02 157.11 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.387 -0.82 . . . . 0.0 110.415 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.502 HG13 ' C ' ' A' ' 47' ' ' ALA . 19.6 mt -143.95 167.81 11.97 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.33 -0.856 . . . . 0.0 110.032 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.409 HG13 ' N ' ' A' ' 50' ' ' THR . 0.3 OUTLIER -147.16 -179.75 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 O-C-N 121.055 -1.028 . . . . 0.0 110.294 179.983 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.447 HG23 ' HD2' ' A' ' 6' ' ' HIS . 87.5 m -146.55 156.66 43.41 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.293 -0.88 . . . . 0.0 109.945 179.829 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.493 HD21 ' CE2' ' A' ' 21' ' ' PHE . 1.5 mt -134.77 125.19 26.44 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.071 -1.018 . . . . 0.0 110.061 179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.66 134.58 40.66 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.29 -0.882 . . . . 0.0 110.456 -179.875 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.502 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 47.1 m-85 -120.25 154.83 34.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.232 -0.917 . . . . 0.0 110.308 179.89 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 13.1 t0 -86.4 -10.06 55.07 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.172 -0.955 . . . . 0.0 110.572 -179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.72 150.53 17.52 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.135 -0.978 . . . . 0.0 110.404 -179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.424 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 24.7 mt-10 -64.08 -39.08 93.29 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.264 -0.898 . . . . 0.0 109.992 179.859 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.471 ' CD1' ' NE2' ' A' ' 61' ' ' GLN . 61.8 t-105 -53.57 -52.13 60.72 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.301 -0.874 . . . . 0.0 109.881 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.441 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 13.8 tt0 -57.37 -35.45 69.98 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.383 -0.823 . . . . 0.0 110.483 -179.344 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.424 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 21.5 ttp85 -59.63 -50.45 73.81 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.083 -1.011 . . . . 0.0 110.966 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -60.93 -33.09 72.62 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.177 -0.952 . . . . 0.0 110.796 -179.408 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.471 ' NE2' ' CD1' ' A' ' 57' ' ' TRP . 52.5 mt-30 -65.62 -47.34 75.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.158 -0.964 . . . . 0.0 110.207 -179.893 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.989 ' O ' HG22 ' A' ' 66' ' ' VAL . 1.0 OUTLIER -55.69 -44.0 76.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.21 -0.931 . . . . 0.0 110.033 179.714 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 89.6 mt -59.22 -35.62 73.96 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.282 -0.886 . . . . 0.0 110.491 -179.663 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 1.7 t -77.72 -18.9 56.07 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.147 -0.971 . . . . 0.0 110.449 -179.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.4 mm-40 -94.63 -9.44 35.0 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.23 -0.919 . . . . 0.0 110.621 -179.431 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.989 HG22 ' O ' ' A' ' 62' ' ' PHE . 27.5 m -141.91 92.92 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.042 -1.036 . . . . 0.0 110.545 179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.532 ' HG3' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -76.18 113.16 13.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.17 -0.956 . . . . 0.0 109.933 179.692 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.862 HG22 ' HD2' ' A' ' 69' ' ' PRO . 0.0 OUTLIER -89.76 162.94 34.5 Favored Pre-proline 0 N--CA 1.498 1.939 0 O-C-N 121.096 -1.003 . . . . 0.0 109.765 179.868 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.862 ' HD2' HG22 ' A' ' 68' ' ' ILE . 46.7 Cg_endo -60.93 -178.9 0.25 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.893 1.47 . . . . 0.0 110.133 179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -91.97 -6.15 51.79 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.093 -1.005 . . . . 0.0 110.44 -179.732 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 85.0 m -84.58 -20.35 31.61 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.201 -0.937 . . . . 0.0 110.022 179.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.533 ' CG2' ' HG ' ' A' ' 7' ' ' LEU . 33.0 mt -94.38 107.18 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.276 -0.89 . . . . 0.0 110.204 179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 93.4 m -95.44 157.38 15.92 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.351 -0.843 . . . . 0.0 111.055 -179.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.72 ' CG2' HG13 ' A' ' 5' ' ' VAL . 8.8 p -142.2 130.66 21.61 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 CA-C-O 121.938 0.875 . . . . 0.0 111.24 -178.881 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.75 172.79 6.64 Favored 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.311 0.577 . . . . 0.0 110.474 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 31.9 p -111.54 144.33 40.95 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.393 -0.817 . . . . 0.0 109.975 179.581 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -154.61 176.22 32.45 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.812 -1.315 . . . . 0.0 109.812 -179.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -147.72 146.75 29.36 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.316 -1.108 . . . . 0.0 110.139 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.436 ' SD ' HG21 ' A' ' 4' ' ' ILE . 25.2 mtt -120.22 176.97 5.19 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.097 -1.002 . . . . 0.0 110.324 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 47.9 t -139.67 107.33 5.62 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.315 -0.866 . . . . 0.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.49 1.571 0 CA-C-O 118.03 -0.986 . . . . 0.0 110.309 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 2.3 mtp . . . . . 0 N--CA 1.491 1.589 0 CA-C-O 121.217 0.532 . . . . 0.0 110.275 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.716 ' O ' HG23 ' B' ' 2' ' ' THR . 15.2 t -92.21 113.82 60.35 Favored Pre-proline 0 N--CA 1.492 1.64 0 O-C-N 121.23 -0.919 . . . . 0.0 109.94 179.714 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.501 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 47.8 Cg_endo -62.4 160.15 32.72 Favored 'Trans proline' 0 C--N 1.304 -1.804 0 O-C-N 123.999 1.526 . . . . 0.0 110.333 -179.9 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.471 HG21 ' SD ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -143.31 122.02 7.66 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.251 -0.906 . . . . 0.0 109.896 179.768 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.732 HG13 ' CG2' ' B' ' 74' ' ' VAL . 85.0 t -94.13 130.02 43.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.58 0 O-C-N 121.318 -0.864 . . . . 0.0 110.676 -179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.537 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.0 OUTLIER -105.5 122.97 47.1 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.279 -0.888 . . . . 0.0 109.565 179.409 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.547 ' HG ' ' CG2' ' B' ' 72' ' ' ILE . 0.7 OUTLIER -116.28 135.65 53.7 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.174 -0.954 . . . . 0.0 110.777 -179.427 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.499 ' O ' ' HA ' ' B' ' 72' ' ' ILE . 4.4 ttpp -140.66 165.42 27.53 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.236 -0.915 . . . . 0.0 109.959 -179.965 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.456 ' O ' ' HB2' ' B' ' 46' ' ' SER . . . 151.58 -155.78 26.33 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 109.932 -1.267 . . . . 0.0 109.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -65.0 130.96 45.26 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.301 -1.117 . . . . 0.0 110.644 -179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.507 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.75 -62.66 1.47 Allowed 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.393 -0.817 . . . . 0.0 110.613 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -45.64 -46.61 14.68 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.124 -0.985 . . . . 0.0 110.673 -179.603 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.423 HG22 HD11 ' B' ' 17' ' ' LEU . 97.1 m -58.09 -30.6 66.37 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.226 -0.921 . . . . 0.0 110.493 -179.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.952 ' HA ' HD12 ' B' ' 17' ' ' LEU . 6.8 mt -70.83 -32.93 70.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.199 -0.938 . . . . 0.0 110.259 -179.805 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 16.5 mmtt -59.34 -44.44 92.64 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.295 -0.878 . . . . 0.0 110.651 -179.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.456 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 16.4 t -70.14 -38.11 75.42 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.28 -0.888 . . . . 0.0 111.151 -179.428 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.952 HD12 ' HA ' ' B' ' 14' ' ' LEU . 21.6 mt -58.65 -55.66 32.18 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.067 -1.02 . . . . 0.0 110.334 -179.509 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 58.9 ttp180 -45.96 -29.05 1.29 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.264 -0.897 . . . . 0.0 110.251 179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.456 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 60.0 t80 -64.76 -29.5 70.48 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.298 -0.876 . . . . 0.0 109.968 179.938 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 93.7 mtt180 -68.95 -21.58 64.17 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.32 -0.863 . . . . 0.0 110.015 179.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.509 ' CE2' HD21 ' B' ' 51' ' ' LEU . 9.5 m-30 -66.41 -36.94 84.09 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.266 -0.897 . . . . 0.0 110.051 179.828 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 29.3 mmtm -63.38 -40.83 98.32 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.224 -0.922 . . . . 0.0 110.015 179.932 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.8 mmtm -75.05 -1.78 24.4 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.189 -0.944 . . . . 0.0 109.659 179.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.46 ' HB3' HD12 ' B' ' 27' ' ' LEU . 84.0 m-70 -144.86 35.19 1.13 Allowed 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.443 -0.786 . . . . 0.0 109.421 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.526 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 1.7 t -57.61 -8.7 0.93 Allowed 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.437 -0.789 . . . . 0.0 111.045 -179.674 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 66.7 p -95.78 4.54 52.81 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.011 -1.056 . . . . 0.0 110.392 -179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.501 ' HA ' HD23 ' B' ' 27' ' ' LEU . 8.7 mt -92.32 -49.81 5.97 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.168 -0.957 . . . . 0.0 110.053 179.742 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.526 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 10.4 p90 -99.45 165.71 11.52 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.188 -0.945 . . . . 0.0 109.859 179.621 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 8.7 m -101.46 -30.96 11.14 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.037 -1.04 . . . . 0.0 110.969 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.37 111.63 2.14 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.072 -1.018 . . . . 0.0 110.71 -179.84 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.505 HG12 HD23 ' B' ' 51' ' ' LEU . 32.9 m -90.59 143.35 11.39 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.25 -0.906 . . . . 0.0 110.127 179.492 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.622 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.0 OUTLIER -92.09 144.99 24.87 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.15 -0.969 . . . . 0.0 110.459 -179.932 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -61.46 161.7 9.08 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.274 -0.891 . . . . 0.0 110.381 179.884 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 15.7 m -68.09 132.14 46.69 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.279 -0.888 . . . . 0.0 110.508 -179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.6 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 56.1 p-90 -146.76 -177.97 5.93 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.298 -0.876 . . . . 0.0 109.774 179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.637 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 25.0 t60 -162.38 174.48 12.71 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 120.951 -1.093 . . . . 0.0 110.548 -179.573 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.637 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 39.3 m95 -78.37 100.06 6.62 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.402 -0.811 . . . . 0.0 109.763 179.96 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 24.5 p -116.18 179.44 3.99 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.395 -0.815 . . . . 0.0 110.314 -179.667 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -175.7 -103.44 0.17 Allowed Glycine 0 N--CA 1.491 2.302 0 N-CA-C 109.409 -1.477 . . . . 0.0 109.409 179.966 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -117.5 -65.49 1.18 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.276 -1.132 . . . . 0.0 110.194 179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 14.0 m120 -98.08 99.46 10.73 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.191 -0.943 . . . . 0.0 110.101 179.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.443 ' O ' HG23 ' B' ' 42' ' ' VAL . 11.2 m -134.43 114.96 19.25 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.17 -0.956 . . . . 0.0 110.601 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 19.5 mtpt -68.48 -80.25 0.05 OUTLIER 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.206 -0.934 . . . . 0.0 109.92 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . 0.574 ' CG ' ' O ' ' B' ' 44' ' ' HIS . 40.0 p-80 -165.27 120.67 1.34 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.33 -0.856 . . . . 0.0 109.917 179.722 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . 0.61 ' HB2' ' CE1' ' B' ' 36' ' ' HIS . 15.4 mmtt -115.65 -133.4 0.33 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.233 -0.917 . . . . 0.0 110.276 -179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.456 ' HB2' ' O ' ' B' ' 9' ' ' GLY . 76.8 p -130.96 106.9 8.71 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.041 -1.037 . . . . 0.0 110.614 -179.688 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.502 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -40.21 157.1 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.4 -0.812 . . . . 0.0 110.399 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.502 HG13 ' C ' ' B' ' 47' ' ' ALA . 20.0 mt -143.96 168.21 11.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 121.398 -0.814 . . . . 0.0 110.102 -179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.414 HG13 ' N ' ' B' ' 50' ' ' THR . 0.3 OUTLIER -147.46 -179.8 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.11 -0.993 . . . . 0.0 110.254 179.727 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.444 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 89.9 m -146.41 156.76 43.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.212 -0.93 . . . . 0.0 109.852 179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.509 HD21 ' CE2' ' B' ' 21' ' ' PHE . 1.6 mt -134.62 125.33 26.96 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.983 -1.073 . . . . 0.0 110.123 -179.992 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.87 134.31 41.18 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.283 -0.886 . . . . 0.0 110.482 -179.877 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.501 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 47.3 m-85 -120.29 155.01 34.15 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.289 -0.882 . . . . 0.0 110.243 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 13.0 t0 -86.39 -10.67 53.87 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.235 -0.916 . . . . 0.0 110.521 -179.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -160.07 150.25 18.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.04 -1.038 . . . . 0.0 110.567 -179.937 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.418 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 25.9 mt-10 -63.62 -39.14 93.62 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.254 -0.904 . . . . 0.0 109.938 179.73 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . 0.476 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 62.2 t-105 -53.6 -52.18 60.65 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.226 -0.922 . . . . 0.0 109.851 179.775 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 15.1 tt0 -57.3 -35.64 70.08 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.38 -0.825 . . . . 0.0 110.621 -179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.418 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 22.1 ttp85 -59.68 -50.02 75.49 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.088 -1.008 . . . . 0.0 110.956 -179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 36.6 t0 -60.97 -33.36 73.09 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.249 -0.907 . . . . 0.0 110.817 -179.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.476 ' NE2' ' CD1' ' B' ' 57' ' ' TRP . 53.3 mt-30 -65.64 -47.32 75.98 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.085 -1.01 . . . . 0.0 110.368 -179.777 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.984 ' O ' HG22 ' B' ' 66' ' ' VAL . 0.8 OUTLIER -55.67 -43.89 76.76 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.27 -0.894 . . . . 0.0 109.971 179.74 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 87.0 mt -59.28 -35.56 73.96 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.298 -0.877 . . . . 0.0 110.474 -179.69 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 1.8 t -77.83 -18.65 56.09 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.24 -0.912 . . . . 0.0 110.315 -179.844 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 7.6 mm-40 -94.65 -9.81 33.79 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.115 -0.99 . . . . 0.0 110.566 -179.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.984 HG22 ' O ' ' B' ' 62' ' ' PHE . 27.6 m -141.89 93.28 0.57 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 120.962 -1.086 . . . . 0.0 110.565 -179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.531 ' O ' ' HG3' ' B' ' 67' ' ' LYS . 0.1 OUTLIER -76.33 113.13 13.56 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.228 -0.92 . . . . 0.0 110.081 179.724 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.897 HG22 ' HD2' ' B' ' 69' ' ' PRO . 0.0 OUTLIER -89.56 162.63 35.92 Favored Pre-proline 0 N--CA 1.497 1.891 0 O-C-N 121.153 -0.967 . . . . 0.0 109.611 179.863 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.897 ' HD2' HG22 ' B' ' 68' ' ' ILE . 46.2 Cg_endo -60.64 -177.25 0.16 Allowed 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.841 1.443 . . . . 0.0 110.035 -179.973 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 91.1 mttt -93.51 -5.56 48.8 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.17 -0.956 . . . . 0.0 110.368 -179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 88.0 m -84.59 -20.38 31.54 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.193 -0.942 . . . . 0.0 110.002 179.799 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.547 ' CG2' ' HG ' ' B' ' 7' ' ' LEU . 36.6 mt -94.67 107.46 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.3 -0.875 . . . . 0.0 110.333 -179.987 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 88.9 m -95.33 157.28 15.97 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.394 -0.816 . . . . 0.0 110.881 -179.507 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.732 ' CG2' HG13 ' B' ' 5' ' ' VAL . 8.2 p -141.96 130.51 22.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 CA-C-O 121.948 0.88 . . . . 0.0 111.188 -178.71 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -102.78 171.42 7.42 Favored 'General case' 0 N--CA 1.492 1.656 0 CA-C-O 121.352 0.596 . . . . 0.0 110.554 -179.982 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 33.4 p -110.29 145.37 37.53 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.322 -0.862 . . . . 0.0 109.848 179.424 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -156.12 176.48 33.55 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 109.823 -1.311 . . . . 0.0 109.823 -179.783 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 78.5 m-85 -147.87 147.62 29.96 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.241 -1.152 . . . . 0.0 110.179 -179.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.471 ' SD ' HG21 ' B' ' 4' ' ' ILE . 24.4 mtt -120.91 177.81 4.96 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.298 179.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 45.9 t -140.51 107.15 5.34 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.232 -0.917 . . . . 0.0 110.358 -179.766 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.198 179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.491 1.586 0 CA-C-O 121.247 0.546 . . . . 0.0 110.161 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.34 150.89 77.74 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.327 -0.858 . . . . 0.0 110.139 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.495 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 46.4 Cg_endo -100.99 145.78 0.31 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.886 1.466 . . . . 0.0 110.313 179.871 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.78 167.68 12.43 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.215 -0.928 . . . . 0.0 110.145 -179.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 13.1 t -145.91 130.29 11.51 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.201 -0.937 . . . . 0.0 110.413 -179.686 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.541 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.8 m170 -105.98 125.16 50.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.252 -0.905 . . . . 0.0 109.959 179.67 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.522 HD23 HD11 ' A' ' 51' ' ' LEU . 1.9 pp -121.92 146.77 46.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.084 -1.01 . . . . 0.0 110.478 -179.712 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.611 ' O ' HD13 ' A' ' 72' ' ' ILE . 12.4 ttmm -139.35 161.96 36.19 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.22 -0.925 . . . . 0.0 110.483 -179.244 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.45 -165.93 38.13 Favored Glycine 0 N--CA 1.492 2.384 0 N-CA-C 109.458 -1.457 . . . . 0.0 109.458 -179.937 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 53.3 m-20 -65.05 140.37 58.83 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.13 -1.217 . . . . 0.0 110.219 179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.455 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.42 -49.81 53.76 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.324 -0.86 . . . . 0.0 110.498 -179.98 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -64.54 -43.53 93.7 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.279 -0.888 . . . . 0.0 110.845 -179.606 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 63.7 m -57.81 -24.84 59.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.127 -0.983 . . . . 0.0 110.433 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.495 HD22 HD11 ' A' ' 7' ' ' LEU . 46.6 mt -79.75 -30.94 40.93 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.175 -0.953 . . . . 0.0 109.885 179.761 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 28.6 mmtt -59.49 -41.82 90.68 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.478 -0.764 . . . . 0.0 110.558 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 11.8 t -69.53 -37.13 76.98 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.301 -0.874 . . . . 0.0 110.603 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.41 HD12 ' HA ' ' A' ' 14' ' ' LEU . 11.9 mt -59.07 -52.36 66.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.154 -0.967 . . . . 0.0 110.613 -179.937 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -45.24 -31.39 1.5 Allowed 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.239 -0.913 . . . . 0.0 110.679 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 83.6 t80 -64.82 -40.69 95.59 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.173 -0.954 . . . . 0.0 110.246 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 31.2 mtt180 -66.91 -35.92 81.08 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.232 -0.917 . . . . 0.0 110.218 179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.421 ' N ' ' CD1' ' A' ' 21' ' ' PHE . 10.1 m-30 -66.45 -35.38 80.16 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.237 -0.915 . . . . 0.0 110.32 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 24.4 mmtm -63.43 -40.57 97.51 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.166 -0.959 . . . . 0.0 110.337 -179.837 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -75.01 -37.85 61.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.166 -0.959 . . . . 0.0 110.318 -179.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.632 ' O ' ' N ' ' A' ' 26' ' ' THR . 90.7 m-70 -95.44 33.75 1.55 Allowed 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.163 -0.961 . . . . 0.0 110.443 -179.803 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.579 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 32.0 p -59.36 53.36 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.489 -0.757 . . . . 0.0 111.275 -179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.632 ' N ' ' O ' ' A' ' 24' ' ' HIS . 14.8 p -144.42 34.63 1.18 Allowed 'General case' 0 N--CA 1.49 1.543 0 O-C-N 120.936 -1.102 . . . . 0.0 109.853 179.806 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.7 HD23 ' HG3' ' A' ' 58' ' ' GLN . 10.4 mt -146.77 -21.69 0.42 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.194 -0.941 . . . . 0.0 111.382 -179.404 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.62 ' CE2' ' CG2' ' A' ' 31' ' ' VAL . 39.8 p90 -115.42 166.64 11.66 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.442 -1.411 . . . . 0.0 109.56 179.436 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -100.85 -32.33 10.73 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 120.923 -1.111 . . . . 0.0 111.514 -179.128 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.605 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.45 117.7 2.8 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 120.801 -1.187 . . . . 0.0 111.111 -179.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.62 ' CG2' ' CE2' ' A' ' 28' ' ' TYR . 5.1 t -89.84 102.16 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.226 -0.921 . . . . 0.0 110.025 179.414 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.595 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 5.0 p -69.39 147.05 51.54 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.211 -0.931 . . . . 0.0 110.482 -179.767 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.35 161.1 9.66 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.297 -0.877 . . . . 0.0 110.226 179.884 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.558 ' HA ' HG22 ' A' ' 49' ' ' VAL . 3.0 t -68.28 140.79 55.99 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.383 -0.823 . . . . 0.0 110.753 -179.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.605 ' CE3' ' HB2' ' B' ' 32' ' ' SER . 63.2 p-90 -146.95 -176.1 5.07 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.405 -0.809 . . . . 0.0 109.418 179.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.54 ' HB2' ' HA ' ' A' ' 46' ' ' SER . 2.5 p-80 -162.57 174.32 12.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.89 -1.131 . . . . 0.0 111.047 -179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.597 ' O ' HG21 ' A' ' 42' ' ' VAL . 57.7 m95 -79.13 118.46 21.12 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.538 -0.726 . . . . 0.0 110.09 -179.832 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 24.0 m -89.1 87.57 7.24 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.334 -0.854 . . . . 0.0 110.306 -179.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -132.33 162.15 23.97 Favored Glycine 0 N--CA 1.492 2.373 0 N-CA-C 109.58 -1.408 . . . . 0.0 109.58 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -53.2 -62.14 1.85 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.247 -1.149 . . . . 0.0 110.004 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 29.2 m120 -91.06 90.5 7.87 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.327 -0.858 . . . . 0.0 110.032 179.853 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.597 HG21 ' O ' ' A' ' 37' ' ' TRP . 8.0 p -145.8 17.2 0.21 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.206 -0.934 . . . . 0.0 110.368 -179.866 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 35.5 tttp -56.25 -17.71 8.32 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.231 -0.918 . . . . 0.0 109.998 179.843 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.452 ' CD2' ' H ' ' A' ' 44' ' ' HIS . 62.4 m-70 -54.26 -68.28 0.19 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.373 -0.83 . . . . 0.0 110.045 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 37.4 mmtt -122.15 168.84 11.5 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.283 -0.885 . . . . 0.0 110.055 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.54 ' HA ' ' HB2' ' A' ' 36' ' ' HIS . 73.3 p -170.14 37.54 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.195 -0.941 . . . . 0.0 110.168 179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -167.2 110.16 0.68 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.214 -0.929 . . . . 0.0 110.418 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.538 ' N ' ' O ' ' A' ' 35' ' ' TRP . 16.8 mt -142.74 141.85 26.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 121.297 -0.877 . . . . 0.0 109.958 -179.941 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.558 HG22 ' HA ' ' A' ' 34' ' ' THR . 91.7 t -124.37 122.75 64.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.083 -1.011 . . . . 0.0 110.427 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.5 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 20.7 m -94.37 157.32 16.08 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.289 -0.882 . . . . 0.0 110.116 179.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.522 HD11 HD23 ' A' ' 7' ' ' LEU . 1.2 mt -135.32 130.98 35.88 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.254 -0.904 . . . . 0.0 110.198 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.605 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 63.4 p -96.76 127.29 42.6 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.237 -0.914 . . . . 0.0 110.464 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.556 ' OH ' ' CE2' ' A' ' 62' ' ' PHE . 27.4 m-85 -103.78 146.39 28.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.236 -0.915 . . . . 0.0 110.026 179.834 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.59 -9.68 55.56 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.175 -0.953 . . . . 0.0 110.769 -179.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 70.9 p -162.62 134.98 5.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.068 -1.02 . . . . 0.0 110.591 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.409 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 0.0 OUTLIER -51.93 -40.16 60.34 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.292 -0.88 . . . . 0.0 109.848 179.64 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 4.7 t-105 -53.55 -55.27 27.04 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.441 -0.787 . . . . 0.0 109.995 179.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.7 ' HG3' HD23 ' A' ' 27' ' ' LEU . 16.3 tt0 -57.03 -35.37 69.21 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.332 -0.855 . . . . 0.0 110.39 -179.374 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.479 ' O ' ' HB3' ' A' ' 62' ' ' PHE . 7.3 ttp85 -59.52 -33.48 71.42 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.096 -1.003 . . . . 0.0 109.992 179.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.454 ' O ' ' HG ' ' A' ' 63' ' ' LEU . 0.4 OUTLIER -61.53 -60.8 3.14 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.359 -0.838 . . . . 0.0 111.305 -179.501 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.524 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 4.1 pm0 -65.14 -18.85 65.65 Favored 'General case' 0 N--CA 1.487 1.424 0 O-C-N 121.006 -1.059 . . . . 0.0 110.758 -179.102 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.599 ' O ' HG22 ' A' ' 66' ' ' VAL . 38.4 t80 -57.25 -65.01 0.7 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.009 -1.057 . . . . 0.0 110.401 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.577 ' HA ' HG22 ' A' ' 66' ' ' VAL . 0.4 OUTLIER -59.51 -39.86 85.2 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.478 -0.764 . . . . 0.0 111.312 -179.235 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.51 -22.03 66.68 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.907 -1.121 . . . . 0.0 110.393 -179.753 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.524 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 15.6 mm-40 -95.37 -30.54 13.86 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.344 -0.848 . . . . 0.0 109.967 -179.643 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.799 ' O ' HG23 ' A' ' 66' ' ' VAL . 15.1 m -97.91 85.92 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.548 0 O-C-N 121.302 -0.874 . . . . 0.0 109.72 179.786 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.47 ' C ' ' O ' ' A' ' 66' ' ' VAL . 0.2 OUTLIER -38.44 105.77 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.342 -0.849 . . . . 0.0 110.441 -179.639 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.507 ' O ' HG23 ' A' ' 68' ' ' ILE . 10.9 tt -89.53 126.67 57.4 Favored Pre-proline 0 N--CA 1.489 1.491 0 O-C-N 121.532 -0.73 . . . . 0.0 110.17 179.684 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 45.0 Cg_endo -68.08 -177.81 1.48 Allowed 'Trans proline' 0 C--N 1.304 -1.78 0 O-C-N 123.926 1.487 . . . . 0.0 110.396 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.2 tttp -86.64 -12.79 47.47 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.216 -0.928 . . . . 0.0 110.226 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.74 -11.21 56.28 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.262 -0.899 . . . . 0.0 110.165 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.611 HD13 ' O ' ' A' ' 8' ' ' LYS . 9.8 mm -94.37 121.33 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.572 0 O-C-N 121.16 -0.962 . . . . 0.0 109.96 179.623 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 25.3 m -95.23 136.09 36.0 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.05 -1.031 . . . . 0.0 109.818 179.589 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 11.2 t -88.75 156.97 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.055 -1.028 . . . . 0.0 110.871 -178.371 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.541 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 1.2 m -142.73 154.83 44.65 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.833 -0.542 . . . . 0.0 110.341 -179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 21.1 p -133.0 134.98 45.18 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.118 -0.989 . . . . 0.0 110.075 179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.6 -175.57 30.71 Favored Glycine 0 N--CA 1.492 2.403 0 N-CA-C 109.507 -1.437 . . . . 0.0 109.507 -179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 62.8 m-85 -148.1 152.78 37.93 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.206 -1.173 . . . . 0.0 110.528 -179.899 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -123.74 169.69 11.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.334 -0.854 . . . . 0.0 109.949 179.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.713 ' C ' HD12 ' A' ' 81' ' ' ILE . 9.6 t -150.22 99.65 2.82 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.244 -0.91 . . . . 0.0 110.287 179.959 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.713 HD12 ' C ' ' A' ' 80' ' ' SER . 1.1 mp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 118.012 -0.994 . . . . 0.0 110.051 179.751 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.627 0 CA-C-O 121.306 0.574 . . . . 0.0 110.269 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -131.2 150.45 76.54 Favored Pre-proline 0 N--CA 1.491 1.587 0 O-C-N 121.25 -0.906 . . . . 0.0 110.094 -179.881 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.507 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 49.2 Cg_endo -100.19 145.59 0.38 Allowed 'Trans proline' 0 C--N 1.304 -1.791 0 O-C-N 123.94 1.494 . . . . 0.0 110.187 179.775 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . 2.2 pt -143.72 168.09 12.14 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 O-C-N 121.218 -0.926 . . . . 0.0 110.02 -179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 12.4 t -146.12 130.35 11.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.213 -0.93 . . . . 0.0 110.426 -179.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.569 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 1.7 m170 -106.09 125.64 51.23 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.297 -0.877 . . . . 0.0 109.782 179.613 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.517 HD23 HD11 ' B' ' 51' ' ' LEU . 1.9 pp -122.76 147.26 46.71 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.987 -1.071 . . . . 0.0 110.536 -179.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.625 ' O ' HD13 ' B' ' 72' ' ' ILE . 12.4 ttmm -139.61 162.03 36.07 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.288 -0.882 . . . . 0.0 110.465 -179.242 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 165.84 -166.38 38.57 Favored Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.415 -1.474 . . . . 0.0 109.415 -179.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 51.4 m-20 -64.93 140.18 58.84 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -1.172 . . . . 0.0 110.252 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.453 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.97 -49.56 49.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.253 -0.905 . . . . 0.0 110.503 -179.856 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 14.2 m120 -65.0 -43.52 92.27 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.234 -0.916 . . . . 0.0 110.828 -179.559 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 75.5 m -57.64 -24.28 55.7 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.184 -0.948 . . . . 0.0 110.504 -179.488 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.479 HD22 HD11 ' B' ' 7' ' ' LEU . 41.7 mt -80.82 -30.64 35.78 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.155 -0.966 . . . . 0.0 109.918 179.883 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 28.7 mmtt -59.42 -41.91 90.6 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.406 -0.808 . . . . 0.0 110.45 -179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 11.7 t -69.78 -37.27 76.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.369 -0.832 . . . . 0.0 110.605 -179.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 11.6 mt -58.82 -51.55 69.54 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.033 -1.042 . . . . 0.0 110.297 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 32.5 ttp85 -45.49 -31.69 1.88 Allowed 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.291 -0.88 . . . . 0.0 110.582 -179.712 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 83.7 t80 -64.78 -40.6 95.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.109 -0.994 . . . . 0.0 110.239 -179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 33.1 mtt180 -67.15 -35.76 80.38 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.145 -0.972 . . . . 0.0 110.156 -179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.427 ' N ' ' CD1' ' B' ' 21' ' ' PHE . 10.1 m-30 -66.43 -35.11 79.49 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.279 -0.888 . . . . 0.0 110.321 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 24.5 mmtm -63.51 -40.87 98.19 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.223 -0.923 . . . . 0.0 110.313 -179.976 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.6 tptt -75.02 -38.03 61.61 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.165 -0.96 . . . . 0.0 110.452 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.633 ' O ' ' N ' ' B' ' 26' ' ' THR . 91.3 m-70 -95.25 33.8 1.51 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.202 -0.936 . . . . 0.0 110.348 -179.891 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.594 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 32.0 p -59.34 53.05 0.0 OUTLIER 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.536 -0.727 . . . . 0.0 111.318 179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.633 ' N ' ' O ' ' B' ' 24' ' ' HIS . 9.3 p -144.38 34.73 1.19 Allowed 'General case' 0 N--CA 1.489 1.517 0 O-C-N 120.908 -1.12 . . . . 0.0 109.822 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.678 HD23 ' HG3' ' B' ' 58' ' ' GLN . 10.9 mt -146.9 -21.47 0.41 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.181 -0.949 . . . . 0.0 111.356 -179.403 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.594 ' CE1' ' HA ' ' B' ' 25' ' ' CYS . 39.5 p90 -115.45 166.73 11.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.604 -1.31 . . . . 0.0 109.558 179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -100.95 -32.6 10.57 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 120.941 -1.099 . . . . 0.0 111.583 -179.13 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.598 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.58 118.07 2.8 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.816 -1.177 . . . . 0.0 111.08 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.593 ' CG2' ' CE2' ' B' ' 28' ' ' TYR . 4.6 t -89.91 101.08 11.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.361 -0.837 . . . . 0.0 110.086 179.606 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.605 ' HB2' ' CE3' ' A' ' 35' ' ' TRP . 5.5 p -67.85 146.78 53.33 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.075 -1.016 . . . . 0.0 110.438 -179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.38 161.6 9.03 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.221 -0.925 . . . . 0.0 110.239 179.978 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.564 ' HA ' HG22 ' B' ' 49' ' ' VAL . 3.5 t -68.27 140.38 55.99 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.3 -0.875 . . . . 0.0 110.628 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.595 ' CZ3' ' HB3' ' A' ' 32' ' ' SER . 62.8 p-90 -147.03 -176.43 5.21 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.369 -0.832 . . . . 0.0 109.542 179.619 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.539 ' HB2' ' HA ' ' B' ' 46' ' ' SER . 2.6 p-80 -162.44 174.4 12.77 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.839 -1.163 . . . . 0.0 111.121 -179.8 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.597 ' O ' HG21 ' B' ' 42' ' ' VAL . 56.8 m95 -79.21 118.34 21.06 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.447 -0.783 . . . . 0.0 110.183 -179.809 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 20.4 m -89.1 88.3 7.51 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.322 -0.861 . . . . 0.0 110.248 -179.928 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -133.28 161.71 24.22 Favored Glycine 0 N--CA 1.49 2.299 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 1.9 t60 -52.67 -62.71 1.47 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.283 -1.128 . . . . 0.0 110.072 179.969 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 29.3 m120 -90.64 91.12 8.27 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.249 -0.907 . . . . 0.0 110.086 179.868 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.597 HG21 ' O ' ' B' ' 37' ' ' TRP . 8.9 p -146.04 15.23 0.19 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.552 0 O-C-N 121.235 -0.916 . . . . 0.0 110.194 -179.874 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 36.7 tttp -54.42 -17.9 3.6 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.229 -0.919 . . . . 0.0 110.052 179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . 0.449 ' CD2' ' H ' ' B' ' 44' ' ' HIS . 60.1 m-70 -54.51 -67.9 0.23 Allowed 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.283 -0.886 . . . . 0.0 110.215 179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 39.0 mmtt -122.55 166.57 14.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.27 -0.894 . . . . 0.0 110.248 -179.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.539 ' HA ' ' HB2' ' B' ' 36' ' ' HIS . 75.0 p -167.65 35.87 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.274 -0.891 . . . . 0.0 110.484 -179.994 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -165.68 110.72 0.86 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.097 -1.002 . . . . 0.0 110.504 179.908 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.542 ' N ' ' O ' ' B' ' 35' ' ' TRP . 15.9 mt -142.61 142.05 27.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.666 0 O-C-N 121.415 -0.803 . . . . 0.0 109.996 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.564 HG22 ' HA ' ' B' ' 34' ' ' THR . 88.9 t -124.47 121.91 62.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.069 -1.019 . . . . 0.0 110.209 179.957 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.569 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 18.1 m -93.8 157.7 16.02 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.208 -0.933 . . . . 0.0 109.953 179.736 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.517 HD11 HD23 ' B' ' 7' ' ' LEU . 1.2 mt -135.26 131.53 36.7 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.114 -0.991 . . . . 0.0 110.266 -179.732 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.598 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 56.6 p -97.06 127.52 43.1 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.372 -0.83 . . . . 0.0 110.51 -179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.52 ' OH ' ' CE2' ' B' ' 62' ' ' PHE . 28.7 m-85 -104.32 146.43 28.82 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.375 -0.828 . . . . 0.0 109.892 179.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -86.63 -8.65 57.29 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.1 -1.0 . . . . 0.0 110.805 -179.25 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 73.1 p -163.83 135.21 4.67 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.067 -1.02 . . . . 0.0 110.585 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -51.95 -40.27 60.59 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.325 -0.86 . . . . 0.0 109.961 179.676 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 4.6 t-105 -53.42 -54.99 28.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.333 -0.854 . . . . 0.0 109.894 179.773 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.678 ' HG3' HD23 ' B' ' 27' ' ' LEU . 17.4 tt0 -57.02 -36.0 69.93 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.386 -0.821 . . . . 0.0 110.455 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.464 ' O ' ' HB3' ' B' ' 62' ' ' PHE . 6.4 ttp180 -59.54 -33.17 71.07 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 120.971 -1.081 . . . . 0.0 110.128 179.649 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.436 ' O ' ' HG ' ' B' ' 63' ' ' LEU . 0.3 OUTLIER -61.48 -60.81 3.14 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.394 -0.816 . . . . 0.0 111.205 -179.407 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.526 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 4.2 pm0 -65.17 -19.14 65.83 Favored 'General case' 0 N--CA 1.487 1.385 0 O-C-N 121.066 -1.021 . . . . 0.0 110.902 -179.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.612 ' O ' HG22 ' B' ' 66' ' ' VAL . 36.2 t80 -57.02 -65.35 0.63 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.055 -1.028 . . . . 0.0 110.36 179.781 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.58 ' HA ' HG22 ' B' ' 66' ' ' VAL . 0.4 OUTLIER -59.36 -39.37 83.06 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.452 -0.78 . . . . 0.0 111.305 -179.28 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.87 -21.82 66.49 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.859 -1.151 . . . . 0.0 110.292 -179.745 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . 0.526 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 15.4 mm-40 -95.42 -30.95 13.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.267 -0.896 . . . . 0.0 109.985 -179.721 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.797 HG23 ' O ' ' B' ' 66' ' ' VAL . 16.6 m -97.42 85.49 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.259 -0.901 . . . . 0.0 109.895 179.669 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.466 ' C ' ' O ' ' B' ' 66' ' ' VAL . 0.1 OUTLIER -37.84 105.92 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.421 -0.8 . . . . 0.0 110.56 -179.711 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.503 ' O ' HG23 ' B' ' 68' ' ' ILE . 10.3 tt -89.89 126.7 56.62 Favored Pre-proline 0 N--CA 1.488 1.461 0 O-C-N 121.359 -0.838 . . . . 0.0 110.182 179.75 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_endo -67.93 -177.88 1.46 Allowed 'Trans proline' 0 C--N 1.303 -1.826 0 O-C-N 124.018 1.536 . . . . 0.0 110.32 179.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 tttp -86.74 -12.85 47.0 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.26 -0.9 . . . . 0.0 110.248 -179.885 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -84.8 -11.58 55.42 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.288 -0.882 . . . . 0.0 110.216 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.625 HD13 ' O ' ' B' ' 8' ' ' LYS . 9.8 mm -94.3 121.41 44.89 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 121.217 -0.927 . . . . 0.0 109.898 179.651 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.0 m -95.41 136.35 35.9 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.018 -1.052 . . . . 0.0 109.937 179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 11.1 t -88.55 156.92 3.1 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.581 0 O-C-N 121.029 -1.045 . . . . 0.0 111.074 -178.287 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . 0.543 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 1.4 m -142.52 154.76 44.77 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.75 -0.594 . . . . 0.0 110.402 179.948 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 21.0 p -133.1 134.68 44.59 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.175 -0.953 . . . . 0.0 110.103 179.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.51 -175.62 30.67 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.566 -1.414 . . . . 0.0 109.566 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 61.6 m-85 -147.88 153.01 38.55 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.177 -1.19 . . . . 0.0 110.509 -179.846 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 25.3 mtt -124.12 168.6 12.67 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.272 -0.892 . . . . 0.0 110.039 179.832 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.721 ' C ' HD12 ' B' ' 81' ' ' ILE . 9.2 t -149.08 99.87 3.0 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.145 -0.972 . . . . 0.0 110.417 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.721 HD12 ' C ' ' B' ' 80' ' ' SER . 1.1 mp . . . . . 0 N--CA 1.491 1.606 0 CA-C-O 118.035 -0.984 . . . . 0.0 109.969 179.74 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.455 ' HB3' ' CD2' ' A' ' 78' ' ' PHE . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 CA-C-O 121.246 0.546 . . . . 0.0 110.152 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.7 t -146.39 170.89 7.13 Favored Pre-proline 0 N--CA 1.492 1.669 0 O-C-N 121.212 -0.93 . . . . 0.0 110.303 -179.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.515 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 51.9 Cg_endo -104.61 145.6 0.13 Allowed 'Trans proline' 0 C--N 1.307 -1.638 0 O-C-N 124.034 1.544 . . . . 0.0 110.308 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.511 HD11 ' SD ' ' B' ' 79' ' ' MET . 2.8 pt -143.82 162.63 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.212 -0.93 . . . . 0.0 110.041 179.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.534 HG23 HG22 ' A' ' 74' ' ' VAL . 9.6 p -145.78 127.47 8.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.394 -0.816 . . . . 0.0 110.074 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.613 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 1.1 m170 -104.13 118.32 36.37 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.348 -0.845 . . . . 0.0 110.135 -179.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.626 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.3 pp -111.54 150.91 29.31 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.127 -0.983 . . . . 0.0 110.222 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.517 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 7.6 tptm -138.71 159.27 42.52 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.239 -0.913 . . . . 0.0 110.482 -179.132 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.517 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 170.67 -174.56 44.57 Favored Glycine 0 N--CA 1.492 2.42 0 N-CA-C 109.638 -1.385 . . . . 0.0 109.638 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.482 ' HB2' ' HB ' ' A' ' 13' ' ' THR . 40.2 m-20 -65.05 141.49 58.73 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.153 -1.204 . . . . 0.0 110.198 179.895 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.49 ' O ' ' HB2' ' A' ' 14' ' ' LEU . . . -50.33 -69.28 0.12 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.238 -0.914 . . . . 0.0 110.666 -179.805 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 15.9 m120 -47.78 -44.96 28.84 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.065 -1.022 . . . . 0.0 110.385 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.482 ' HB ' ' HB2' ' A' ' 10' ' ' ASP . 41.4 m -58.22 -22.81 53.55 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.257 -0.902 . . . . 0.0 110.61 -179.824 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.49 ' HB2' ' O ' ' A' ' 11' ' ' ALA . 62.8 mt -78.39 -29.79 47.46 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.179 -0.951 . . . . 0.0 110.532 -179.637 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -59.71 -34.44 72.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.211 -0.931 . . . . 0.0 110.417 -179.897 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.504 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.9 t -70.27 -46.13 64.98 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.358 -0.839 . . . . 0.0 110.943 -179.461 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 3.8 mp -58.82 -52.76 64.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.057 -1.027 . . . . 0.0 110.59 -179.529 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.413 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 10.5 ttm180 -45.04 -24.69 0.25 Allowed 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.221 -0.924 . . . . 0.0 110.516 -179.761 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.504 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 40.1 t80 -64.8 -40.46 95.26 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.078 -1.014 . . . . 0.0 110.234 179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.3 mtp180 -72.88 -21.18 60.96 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.316 -0.865 . . . . 0.0 110.134 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.413 ' HB2' ' O ' ' A' ' 18' ' ' ARG . 8.6 m-30 -66.26 -31.32 72.06 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 109.954 179.909 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 5.8 mmtp -63.57 -33.98 76.8 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.338 -0.851 . . . . 0.0 110.336 179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 9.6 mmtm -75.08 -35.15 61.82 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 121.245 -0.909 . . . . 0.0 110.41 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.643 ' HB3' HD12 ' A' ' 27' ' ' LEU . 73.4 m-70 -94.48 40.93 1.09 Allowed 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.243 -0.91 . . . . 0.0 110.12 -179.884 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.581 ' SG ' HG23 ' A' ' 26' ' ' THR . 27.3 p -57.65 -21.52 40.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.355 -0.841 . . . . 0.0 110.512 -179.897 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.581 HG23 ' SG ' ' A' ' 25' ' ' CYS . 69.2 p -96.52 10.91 36.91 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.095 -1.003 . . . . 0.0 110.499 -179.748 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.643 HD12 ' HB3' ' A' ' 24' ' ' HIS . 2.3 mt -92.26 -49.39 6.2 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.289 -0.882 . . . . 0.0 110.16 179.913 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.467 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 4.4 p90 -98.9 168.56 10.03 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.247 -0.908 . . . . 0.0 110.236 -179.996 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 21.1 m -98.92 -31.35 11.87 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.201 -0.937 . . . . 0.0 110.848 -179.534 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.08 116.09 2.72 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.011 -1.056 . . . . 0.0 110.608 -179.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.409 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.2 p -90.2 135.06 27.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.688 0 O-C-N 121.315 -0.866 . . . . 0.0 109.883 179.459 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.486 ' CB ' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -108.37 154.25 22.11 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.083 -1.011 . . . . 0.0 110.689 -179.689 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.35 162.56 7.64 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.359 -0.838 . . . . 0.0 110.265 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.2 t -68.14 131.06 44.73 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.26 -0.9 . . . . 0.0 110.751 -179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.556 ' HB3' ' CB ' ' B' ' 35' ' ' TRP . 3.9 p-90 -146.93 157.51 43.66 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.353 -0.842 . . . . 0.0 109.405 179.448 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.484 ' CG ' ' HB3' ' A' ' 46' ' ' SER . 5.3 p80 -162.58 -173.73 3.67 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.823 -1.173 . . . . 0.0 111.354 -179.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.6 m95 -79.97 138.82 37.15 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.66 -0.65 . . . . 0.0 110.114 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -120.46 31.17 6.58 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.226 -0.921 . . . . 0.0 110.408 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -83.5 -128.54 1.44 Allowed Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.286 -1.526 . . . . 0.0 109.286 179.72 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 11.9 p-80 -112.82 -1.95 14.51 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.246 -1.15 . . . . 0.0 110.027 179.835 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.437 ' C ' HG13 ' A' ' 42' ' ' VAL . 0.2 OUTLIER -85.33 45.46 1.19 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.341 -0.85 . . . . 0.0 110.377 -179.974 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.568 HG23 ' O ' ' A' ' 42' ' ' VAL . 28.3 m -149.13 119.27 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.607 0 O-C-N 121.326 -0.859 . . . . 0.0 110.065 179.803 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 2.3 tttt -47.12 -49.66 21.64 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.269 -0.894 . . . . 0.0 110.21 179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 23.0 t-160 -140.38 -72.76 0.36 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.205 -0.935 . . . . 0.0 110.061 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 12.6 mmtm -131.47 -155.53 0.7 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.252 -0.905 . . . . 0.0 109.761 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.484 ' HB3' ' CG ' ' A' ' 36' ' ' HIS . 40.6 t -171.77 -179.4 2.46 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 120.966 -1.084 . . . . 0.0 110.471 179.98 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.413 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -173.73 118.75 0.28 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.333 -0.855 . . . . 0.0 109.968 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.626 HG23 ' O ' ' A' ' 7' ' ' LEU . 74.1 mt -145.03 133.76 17.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.326 -0.859 . . . . 0.0 110.123 179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.423 ' O ' ' CD2' ' A' ' 7' ' ' LEU . 19.1 t -119.73 130.27 74.35 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.049 -1.032 . . . . 0.0 110.442 179.94 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.58 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 3.0 m -94.16 156.41 16.57 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.336 -0.853 . . . . 0.0 110.234 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.498 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 1.0 OUTLIER -135.01 129.98 34.97 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.245 -0.909 . . . . 0.0 109.637 179.402 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.11 130.94 44.32 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.217 -0.927 . . . . 0.0 110.675 -179.547 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HG2' ' A' ' 3' ' ' PRO . 49.0 m-85 -118.48 155.79 30.21 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.383 -0.823 . . . . 0.0 109.956 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -70.69 -10.32 59.14 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.244 -0.91 . . . . 0.0 110.32 -179.709 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 50.9 p -170.26 166.19 8.83 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.168 -0.958 . . . . 0.0 110.305 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -70.44 -34.96 73.06 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.344 -0.848 . . . . 0.0 110.171 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 35.8 t-105 -53.79 -50.82 65.25 Favored 'General case' 0 N--CA 1.49 1.558 0 O-C-N 121.342 -0.848 . . . . 0.0 110.12 -179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 11.9 tt0 -57.95 -38.04 75.25 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.251 -0.906 . . . . 0.0 110.855 -179.523 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.582 ' HE ' HD11 ' A' ' 63' ' ' LEU . 0.2 OUTLIER -59.18 -44.31 92.17 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.003 -1.06 . . . . 0.0 110.745 -179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.441 ' HA ' HD12 ' A' ' 63' ' ' LEU . 46.7 t0 -61.01 -38.58 86.6 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.104 -0.998 . . . . 0.0 110.518 -179.471 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 33.3 mt-30 -65.92 -41.49 91.32 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.134 -0.979 . . . . 0.0 110.725 -179.649 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.897 ' O ' HG22 ' A' ' 66' ' ' VAL . 2.7 t80 -55.85 -47.4 77.35 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 -179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.582 HD11 ' HE ' ' A' ' 59' ' ' ARG . 13.5 mt -59.44 -44.66 92.9 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.256 -0.903 . . . . 0.0 110.459 -179.812 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -65.68 -21.45 66.54 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.254 -0.904 . . . . 0.0 110.63 -179.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm-40 -95.44 -25.26 16.31 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.085 -1.01 . . . . 0.0 110.369 -179.701 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.897 HG22 ' O ' ' A' ' 62' ' ' PHE . 31.2 m -103.64 105.06 17.67 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.272 -0.892 . . . . 0.0 110.036 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 33.3 tttt -51.4 97.39 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.192 -0.943 . . . . 0.0 110.395 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.618 ' O ' HG23 ' A' ' 68' ' ' ILE . 9.4 tp -88.66 117.5 68.39 Favored Pre-proline 0 N--CA 1.487 1.424 0 O-C-N 121.169 -0.957 . . . . 0.0 109.979 179.823 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.689 ' CG ' HD12 ' A' ' 72' ' ' ILE . 46.2 Cg_endo -60.58 167.97 7.45 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.916 1.482 . . . . 0.0 110.852 -179.528 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 9.7 mttt -79.53 -12.98 59.85 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.45 -0.782 . . . . 0.0 110.315 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.61 -23.73 29.44 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.27 -0.894 . . . . 0.0 110.227 -179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.689 HD12 ' CG ' ' A' ' 69' ' ' PRO . 66.0 mt -93.68 115.27 32.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.236 -0.915 . . . . 0.0 109.913 179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 8.3 m -95.09 142.48 27.5 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.323 -0.861 . . . . 0.0 110.727 -179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.616 HG22 ' H ' ' A' ' 75' ' ' SER . 6.0 p -92.25 178.49 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.421 -0.799 . . . . 0.0 110.582 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.616 ' H ' HG22 ' A' ' 74' ' ' VAL . 0.6 OUTLIER -143.85 158.76 43.47 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.393 -0.817 . . . . 0.0 110.499 179.216 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 22.6 p -133.86 135.12 43.5 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.231 -0.918 . . . . 0.0 110.058 179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -160.74 177.03 37.31 Favored Glycine 0 N--CA 1.491 2.328 0 N-CA-C 109.849 -1.3 . . . . 0.0 109.849 -179.878 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.455 ' CD2' ' HB3' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.93 120.43 8.51 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.287 -1.125 . . . . 0.0 109.969 -179.802 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.518 ' SD ' HD11 ' B' ' 4' ' ' ILE . 18.3 mmm -95.13 171.74 8.55 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.051 -1.031 . . . . 0.0 110.576 -179.716 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.422 ' O ' HG23 ' A' ' 81' ' ' ILE . 86.3 p -153.67 107.81 3.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.33 -0.856 . . . . 0.0 110.305 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.422 HG23 ' O ' ' A' ' 80' ' ' SER . 4.6 pt . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 118.115 -0.945 . . . . 0.0 110.225 179.961 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.487 ' CG ' ' O ' ' B' ' 79' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.647 0 CA-C-O 121.198 0.523 . . . . 0.0 110.11 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.5 t -146.13 171.96 5.84 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.262 -0.899 . . . . 0.0 110.103 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.499 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 51.1 Cg_endo -106.13 145.84 0.1 OUTLIER 'Trans proline' 0 C--N 1.306 -1.681 0 O-C-N 123.847 1.446 . . . . 0.0 110.054 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.518 HD11 ' SD ' ' A' ' 79' ' ' MET . 2.7 pt -143.83 162.79 15.59 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.253 -0.904 . . . . 0.0 110.04 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.562 HG23 HG22 ' B' ' 74' ' ' VAL . 8.6 p -145.67 127.84 9.01 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.336 -0.853 . . . . 0.0 110.08 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.614 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 1.5 m170 -104.66 118.19 35.96 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.355 -0.841 . . . . 0.0 110.148 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.649 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.3 pp -111.35 150.93 29.03 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.182 -0.949 . . . . 0.0 110.219 -179.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.522 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 7.7 tptm -138.56 159.53 41.85 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.278 -0.889 . . . . 0.0 110.381 -179.13 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.522 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 170.23 -174.55 44.3 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.556 -1.418 . . . . 0.0 109.556 -179.964 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . 0.485 ' HB2' ' HB ' ' B' ' 13' ' ' THR . 40.6 m-20 -65.12 141.83 58.57 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.126 -1.22 . . . . 0.0 110.291 -179.971 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.488 ' O ' ' HB2' ' B' ' 14' ' ' LEU . . . -50.37 -69.4 0.11 Allowed 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.315 -0.865 . . . . 0.0 110.524 -179.942 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 15.0 m120 -47.54 -45.49 26.89 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.156 -0.965 . . . . 0.0 110.528 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.485 ' HB ' ' HB2' ' B' ' 10' ' ' ASP . 37.2 m -58.14 -22.09 49.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.135 -0.978 . . . . 0.0 110.723 -179.677 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.488 ' HB2' ' O ' ' B' ' 11' ' ' ALA . 65.2 mt -78.83 -29.69 44.85 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.141 -0.975 . . . . 0.0 110.487 -179.605 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -59.82 -34.4 73.01 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.213 -0.929 . . . . 0.0 110.319 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.506 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 1.6 t -70.31 -46.49 64.15 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.215 -0.928 . . . . 0.0 110.966 -179.558 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 3.7 mp -58.64 -52.81 64.08 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.066 -1.021 . . . . 0.0 110.536 -179.404 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 9.8 ttm180 -45.09 -24.74 0.26 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.303 -0.873 . . . . 0.0 110.621 -179.668 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.506 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 41.5 t80 -64.8 -39.7 94.02 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.179 -0.951 . . . . 0.0 110.216 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 4.9 mtp180 -73.41 -21.29 60.52 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.145 -0.972 . . . . 0.0 110.159 179.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 8.9 m-30 -66.18 -31.43 72.26 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.228 -0.92 . . . . 0.0 109.897 179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 5.5 mmtp -63.49 -33.76 76.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.247 -0.908 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.9 mmtm -75.12 -35.16 61.73 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.175 -0.953 . . . . 0.0 110.436 -179.842 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.643 ' HB3' HD12 ' B' ' 27' ' ' LEU . 76.0 m-70 -94.84 41.16 1.09 Allowed 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.192 -0.942 . . . . 0.0 110.169 -179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.605 ' SG ' HG23 ' B' ' 26' ' ' THR . 27.5 p -57.32 -21.07 32.67 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.359 -0.838 . . . . 0.0 110.379 -179.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.605 HG23 ' SG ' ' B' ' 25' ' ' CYS . 69.8 p -96.91 10.63 38.51 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.128 -0.982 . . . . 0.0 110.467 -179.604 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.643 HD12 ' HB3' ' B' ' 24' ' ' HIS . 2.6 mt -92.23 -49.18 6.31 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.19 -0.944 . . . . 0.0 110.286 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.478 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 4.3 p90 -98.92 168.45 10.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.22 -0.925 . . . . 0.0 110.123 179.949 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 21.5 m -98.78 -31.12 12.04 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.25 -0.906 . . . . 0.0 110.68 -179.583 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.29 116.44 2.7 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.011 -1.056 . . . . 0.0 110.594 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.411 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.2 p -90.27 135.14 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.304 -0.873 . . . . 0.0 109.663 179.318 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.478 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 0.3 OUTLIER -108.2 154.66 21.43 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.114 -0.991 . . . . 0.0 110.615 -179.62 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 7.5 t -61.39 162.44 7.88 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.43 -0.794 . . . . 0.0 110.224 179.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 2.1 t -68.24 130.51 43.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.266 -0.896 . . . . 0.0 110.64 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.556 ' CB ' ' HB3' ' A' ' 35' ' ' TRP . 4.3 p-90 -146.83 157.33 43.63 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.287 -0.883 . . . . 0.0 109.368 179.576 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.476 ' CG ' ' HB3' ' B' ' 46' ' ' SER . 6.2 p80 -162.45 -173.68 3.68 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.866 -1.146 . . . . 0.0 111.359 -179.533 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m95 -79.89 139.94 36.93 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.686 -0.634 . . . . 0.0 109.995 179.638 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -121.54 30.58 6.67 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.199 -0.938 . . . . 0.0 110.322 -179.839 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -82.99 -128.77 1.31 Allowed Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.344 -1.502 . . . . 0.0 109.344 179.841 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 11.4 p-80 -112.58 -1.05 14.97 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.22 -1.165 . . . . 0.0 109.988 179.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . 0.463 ' C ' HG13 ' B' ' 42' ' ' VAL . 0.2 OUTLIER -86.43 46.3 1.33 Allowed 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.349 -0.844 . . . . 0.0 110.2 179.993 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.562 ' O ' HG23 ' B' ' 42' ' ' VAL . 28.2 m -149.92 118.55 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 121.266 -0.896 . . . . 0.0 110.051 179.831 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -46.84 -49.94 19.29 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.308 -0.87 . . . . 0.0 110.116 -179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 22.9 t-160 -139.71 -72.11 0.38 Allowed 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.214 -0.929 . . . . 0.0 110.114 -179.921 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 12.9 mmtm -132.56 -155.0 0.65 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.265 -0.897 . . . . 0.0 109.84 179.863 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.476 ' HB3' ' CG ' ' B' ' 36' ' ' HIS . 43.4 t -172.73 -179.1 2.04 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.939 -1.101 . . . . 0.0 110.684 -179.794 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -174.27 118.92 0.24 Allowed 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.31 -0.869 . . . . 0.0 110.176 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.649 HG23 ' O ' ' B' ' 7' ' ' LEU . 74.7 mt -144.98 133.32 17.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.553 0 O-C-N 121.337 -0.852 . . . . 0.0 109.967 179.478 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.422 ' O ' ' CD2' ' B' ' 7' ' ' LEU . 16.5 t -119.2 130.37 73.99 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 O-C-N 121.038 -1.039 . . . . 0.0 110.424 179.838 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.587 HG23 ' CD2' ' B' ' 6' ' ' HIS . 2.7 m -94.07 157.1 16.25 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.308 -0.87 . . . . 0.0 110.27 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.495 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 1.0 OUTLIER -135.51 129.84 33.71 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.229 -0.919 . . . . 0.0 109.502 179.614 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -97.13 131.01 44.31 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.154 -0.966 . . . . 0.0 110.711 -179.356 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.499 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 44.0 m-85 -118.65 155.44 31.0 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.305 -0.872 . . . . 0.0 110.085 179.836 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 22.4 m-20 -70.8 -10.1 58.84 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.156 -0.965 . . . . 0.0 110.488 -179.717 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 40.7 p -170.1 166.17 9.13 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.209 -0.932 . . . . 0.0 110.269 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 18.1 mt-10 -70.59 -35.1 72.84 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.182 -0.948 . . . . 0.0 110.236 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 36.1 t-105 -53.47 -51.04 64.0 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.403 -0.811 . . . . 0.0 110.224 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 -58.02 -37.18 73.83 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.34 -0.85 . . . . 0.0 110.734 -179.369 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.58 ' HE ' HD11 ' B' ' 63' ' ' LEU . 0.2 OUTLIER -59.55 -44.71 93.18 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.085 -1.01 . . . . 0.0 110.631 -179.931 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.432 ' HA ' HD12 ' B' ' 63' ' ' LEU . 48.0 t0 -60.94 -38.41 85.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.197 -0.94 . . . . 0.0 110.624 -179.45 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 33.8 mt-30 -65.8 -41.44 91.93 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.268 -0.895 . . . . 0.0 110.747 -179.728 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.912 ' O ' HG22 ' B' ' 66' ' ' VAL . 2.3 t80 -55.96 -47.41 77.68 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.156 -0.965 . . . . 0.0 110.24 -179.783 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.58 HD11 ' HE ' ' B' ' 59' ' ' ARG . 13.7 mt -59.48 -43.95 93.14 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.166 -0.959 . . . . 0.0 110.652 -179.658 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -66.37 -21.33 66.23 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.204 -0.935 . . . . 0.0 110.628 -179.774 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.3 mm-40 -95.31 -25.27 16.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.157 -0.964 . . . . 0.0 110.296 -179.78 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.912 HG22 ' O ' ' B' ' 62' ' ' PHE . 32.4 m -103.78 104.81 17.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.3 -0.875 . . . . 0.0 109.952 179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 35.3 tttt -51.34 97.59 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.319 -0.863 . . . . 0.0 110.379 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.595 ' O ' HG23 ' B' ' 68' ' ' ILE . 8.6 tp -88.43 117.77 68.73 Favored Pre-proline 0 N--CA 1.488 1.448 0 O-C-N 121.259 -0.9 . . . . 0.0 109.932 179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.713 ' CG ' HD12 ' B' ' 72' ' ' ILE . 48.7 Cg_endo -61.23 168.25 8.03 Favored 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.889 1.468 . . . . 0.0 110.594 -179.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 10.1 mttt -79.98 -12.81 59.68 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.283 -0.886 . . . . 0.0 110.347 -179.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.6 m -84.53 -23.08 29.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.224 -0.923 . . . . 0.0 110.09 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.713 HD12 ' CG ' ' B' ' 69' ' ' PRO . 67.5 mt -94.21 115.29 32.68 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 O-C-N 121.253 -0.905 . . . . 0.0 110.026 179.876 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 7.7 m -95.23 142.38 27.72 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.33 -0.856 . . . . 0.0 110.839 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.608 HG22 ' H ' ' B' ' 75' ' ' SER . 5.4 p -92.28 178.65 0.55 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.645 0 O-C-N 121.278 -0.889 . . . . 0.0 110.52 179.993 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . 0.614 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -144.03 158.64 43.58 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.397 -0.814 . . . . 0.0 110.622 179.125 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.9 p -133.57 134.72 43.67 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.222 -0.924 . . . . 0.0 110.129 179.45 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -159.94 176.83 36.62 Favored Glycine 0 N--CA 1.491 2.348 0 N-CA-C 109.793 -1.323 . . . . 0.0 109.793 -179.845 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.427 ' CD2' ' HB3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -148.06 119.94 8.16 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.316 -1.108 . . . . 0.0 109.82 179.961 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.511 ' SD ' HD11 ' A' ' 4' ' ' ILE . 19.1 mmm -94.52 173.08 7.8 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.971 -1.081 . . . . 0.0 110.472 -179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.421 ' O ' HG23 ' B' ' 81' ' ' ILE . 85.9 p -154.85 107.16 2.73 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.222 -0.924 . . . . 0.0 110.272 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.421 HG23 ' O ' ' B' ' 80' ' ' SER . 4.8 pt . . . . . 0 N--CA 1.492 1.673 0 CA-C-O 117.921 -1.038 . . . . 0.0 110.262 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.205 0.526 . . . . 0.0 110.117 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 6.5 m -68.61 121.65 81.77 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 121.263 -0.898 . . . . 0.0 110.122 -179.934 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.512 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 47.1 Cg_endo -69.11 157.17 62.68 Favored 'Trans proline' 0 C--N 1.304 -1.783 0 O-C-N 124.08 1.568 . . . . 0.0 110.52 -179.817 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.605 HD11 ' HG2' ' B' ' 79' ' ' MET . 5.1 pt -143.02 169.13 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.231 -0.918 . . . . 0.0 110.031 179.872 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.575 ' CG1' HG21 ' A' ' 74' ' ' VAL . 6.4 t -145.8 125.64 6.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.211 -0.931 . . . . 0.0 110.187 -179.923 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.47 ' O ' HG23 ' A' ' 74' ' ' VAL . 0.0 OUTLIER -106.19 119.02 38.13 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.291 -0.881 . . . . 0.0 110.347 179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.738 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.4 mp -116.5 147.4 41.8 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.312 -0.867 . . . . 0.0 110.177 -179.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 1.074 ' O ' HD12 ' A' ' 72' ' ' ILE . 11.5 tttt -142.42 168.5 19.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.214 -0.929 . . . . 0.0 110.388 -179.606 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.432 ' N ' ' CG ' ' A' ' 8' ' ' LYS . . . 151.76 -166.02 30.73 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.591 -1.403 . . . . 0.0 109.591 179.915 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.483 ' O ' ' HG ' ' A' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 131.01 45.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.194 -1.18 . . . . 0.0 110.253 -179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -49.97 -39.8 41.98 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.28 -0.887 . . . . 0.0 110.726 -179.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -66.08 -46.91 76.02 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.077 -1.015 . . . . 0.0 110.605 -179.642 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.472 ' O ' HD13 ' A' ' 17' ' ' LEU . 5.8 m -58.1 -27.77 64.0 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.2 -0.938 . . . . 0.0 110.367 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.702 HD21 HD13 ' A' ' 72' ' ' ILE . 77.7 mt -77.71 -27.4 50.65 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.15 -0.969 . . . . 0.0 110.34 -179.927 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 24.2 ttmt -59.35 -39.39 83.06 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.252 -0.905 . . . . 0.0 110.411 -179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.49 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 1.2 t -70.19 -34.23 72.7 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.098 -1.001 . . . . 0.0 110.423 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.472 HD13 ' O ' ' A' ' 13' ' ' THR . 5.9 mp -58.94 -51.91 68.01 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.212 -0.93 . . . . 0.0 110.558 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.509 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 1.2 ttp-105 -46.22 -31.86 2.7 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.264 -0.897 . . . . 0.0 110.124 -179.994 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.49 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 48.4 t80 -65.14 -33.06 75.13 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.306 -0.871 . . . . 0.0 110.391 -179.938 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 3.4 mtp85 -74.74 -30.32 61.46 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.203 -0.936 . . . . 0.0 110.465 -179.775 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.509 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 11.1 m-30 -66.32 -21.58 66.26 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.193 -0.942 . . . . 0.0 110.333 -179.969 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . 0.472 ' HE2' ' CB ' ' B' ' 40' ' ' HIS . 29.4 mmtp -63.38 -36.53 84.02 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.17 -0.956 . . . . 0.0 110.615 -179.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -75.1 -40.95 59.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.202 -0.936 . . . . 0.0 110.463 -179.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.626 ' HB3' HD12 ' A' ' 27' ' ' LEU . 15.0 m-70 -95.12 36.52 1.21 Allowed 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.227 -0.921 . . . . 0.0 110.328 -179.692 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.607 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 32.0 p -57.44 -17.92 15.54 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.27 -0.894 . . . . 0.0 110.474 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.95 -3.29 41.99 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.206 -0.934 . . . . 0.0 110.518 -179.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.626 HD12 ' HB3' ' A' ' 24' ' ' HIS . 11.2 mt -92.42 -6.19 50.48 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.181 -0.949 . . . . 0.0 110.495 -179.882 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.607 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 22.7 p90 -144.58 -178.08 5.82 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.194 -0.941 . . . . 0.0 109.528 179.607 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 45.6 m -96.47 -68.99 0.77 Allowed 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.914 -1.116 . . . . 0.0 110.584 -179.224 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.2 20.79 Favored 'General case' 0 C--N 1.304 -1.403 0 O-C-N 121.081 -1.012 . . . . 0.0 109.012 -179.549 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.671 ' O ' HG13 ' A' ' 31' ' ' VAL . 12.7 p -91.29 112.58 25.55 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.945 0 O-C-N 121.681 -0.637 . . . . 0.0 110.511 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.442 ' OG ' ' HB ' ' A' ' 50' ' ' THR . 79.5 p -52.59 152.62 3.55 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 120.926 -1.109 . . . . 0.0 109.373 179.39 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.417 ' OG ' ' HB2' ' B' ' 35' ' ' TRP . 0.8 OUTLIER -60.93 155.08 20.7 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.166 -0.959 . . . . 0.0 110.305 -179.651 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 2.6 m -67.64 129.78 40.97 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.333 -0.855 . . . . 0.0 110.318 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.483 ' HB2' ' OG ' ' B' ' 33' ' ' SER . 44.4 p-90 -146.15 176.15 9.95 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.189 -0.944 . . . . 0.0 109.921 179.984 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.486 ' HB2' ' HA ' ' A' ' 47' ' ' ALA . 53.2 t-80 -162.57 177.83 9.09 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.156 -0.965 . . . . 0.0 110.351 -179.562 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.471 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 80.2 m95 -78.51 123.99 27.66 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.225 -0.922 . . . . 0.0 110.126 -179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 1.8 m -171.31 159.67 5.84 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.37 -0.831 . . . . 0.0 109.916 -179.799 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -132.21 -125.98 2.69 Favored Glycine 0 N--CA 1.491 2.345 0 N-CA-C 109.584 -1.406 . . . . 0.0 109.584 -179.881 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.416 ' HB2' ' CE ' ' B' ' 22' ' ' LYS . 29.9 t-80 -91.2 -40.08 11.74 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.242 -1.152 . . . . 0.0 110.171 179.98 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -135.27 67.02 1.5 Allowed 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.349 -0.844 . . . . 0.0 110.22 -179.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.522 HG12 ' N ' ' A' ' 43' ' ' LYS . 41.1 t -121.53 171.46 10.21 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 O-C-N 121.284 -0.885 . . . . 0.0 110.196 179.911 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.522 ' N ' HG12 ' A' ' 42' ' ' VAL . 36.1 mtpt -94.66 177.63 5.86 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.303 -0.873 . . . . 0.0 110.197 -179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 53.6 t60 -115.53 136.18 53.33 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.271 -0.893 . . . . 0.0 109.893 179.73 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -110.23 -70.42 0.81 Allowed 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.19 -0.944 . . . . 0.0 110.533 -179.705 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.497 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.3 OUTLIER -154.16 106.2 2.78 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.221 -0.925 . . . . 0.0 110.389 -179.845 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.487 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -40.54 157.88 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.42 -0.8 . . . . 0.0 110.068 179.979 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.738 HG23 ' O ' ' A' ' 7' ' ' LEU . 70.3 mt -142.07 144.56 25.09 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.53 0 O-C-N 121.243 -0.91 . . . . 0.0 110.353 -179.485 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.535 HG12 ' N ' ' A' ' 50' ' ' THR . 67.5 t -116.79 169.07 7.53 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.285 -0.884 . . . . 0.0 110.458 -179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.535 ' N ' HG12 ' A' ' 49' ' ' VAL . 17.4 m -146.05 152.16 38.89 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.369 -0.832 . . . . 0.0 109.891 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -135.42 128.78 32.17 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.169 -0.957 . . . . 0.0 110.249 -179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.47 ' OG1' ' CZ3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.61 40.35 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.361 -0.837 . . . . 0.0 110.158 179.847 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.541 ' CD2' ' HA ' ' A' ' 59' ' ' ARG . 40.2 m-85 -111.91 147.35 36.01 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.203 -0.936 . . . . 0.0 109.93 179.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 11.1 m-20 -93.21 -3.28 54.08 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.071 -1.018 . . . . 0.0 110.941 -179.381 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 95.1 p -157.66 121.04 4.03 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.028 -1.045 . . . . 0.0 110.328 -179.906 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.485 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 2.3 mt-10 -46.32 -42.44 14.72 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.314 -0.867 . . . . 0.0 110.132 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.413 ' CD1' ' NE2' ' A' ' 61' ' ' GLN . 16.0 t-105 -53.66 -56.0 21.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.15 -0.969 . . . . 0.0 110.127 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 17.2 tt0 -59.07 -31.21 68.68 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.291 -0.881 . . . . 0.0 110.629 -179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.541 ' HA ' ' CD2' ' A' ' 53' ' ' TYR . 0.1 OUTLIER -59.34 -54.55 45.43 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.273 -0.892 . . . . 0.0 111.061 -179.583 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -61.0 -31.7 71.3 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.153 -0.967 . . . . 0.0 110.975 -179.243 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.432 ' O ' ' CG ' ' A' ' 65' ' ' GLN . 51.4 mt-30 -65.64 -46.48 79.03 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.115 -0.991 . . . . 0.0 110.761 -179.505 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.713 ' O ' HG12 ' A' ' 66' ' ' VAL . 38.4 t80 -56.46 -67.49 0.3 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.319 -0.863 . . . . 0.0 111.007 -179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.606 HD12 ' C ' ' A' ' 63' ' ' LEU . 4.2 pp -59.17 -12.98 5.93 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.227 -0.921 . . . . 0.0 110.98 -179.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 10.0 t -88.59 -23.41 23.12 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.036 -1.04 . . . . 0.0 109.97 179.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.432 ' CG ' ' O ' ' A' ' 61' ' ' GLN . 3.6 mm100 -97.67 -44.34 6.81 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.461 -0.774 . . . . 0.0 109.829 179.65 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.713 HG12 ' O ' ' A' ' 62' ' ' PHE . 1.8 p -98.45 91.67 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.416 -0.802 . . . . 0.0 109.935 179.785 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.451 ' C ' HG12 ' A' ' 68' ' ' ILE . 19.1 pttp -65.29 -177.11 0.36 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.447 -0.783 . . . . 0.0 110.44 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.952 HG22 ' HD2' ' A' ' 69' ' ' PRO . 0.1 OUTLIER -151.09 149.92 26.12 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.286 -0.884 . . . . 0.0 109.52 -179.878 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.952 ' HD2' HG22 ' A' ' 68' ' ' ILE . 44.8 Cg_endo -49.7 -177.75 0.01 OUTLIER 'Trans proline' 0 C--N 1.309 -1.543 0 O-C-N 123.807 1.425 . . . . 0.0 110.455 -179.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.74 -3.42 42.47 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.294 -0.879 . . . . 0.0 110.683 -179.516 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -84.73 -23.15 29.41 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.096 -1.002 . . . . 0.0 109.934 179.687 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 1.074 HD12 ' O ' ' A' ' 8' ' ' LYS . 2.2 tp -94.58 106.34 18.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.393 -0.817 . . . . 0.0 110.212 179.858 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 28.5 m -97.34 156.37 16.48 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.049 -1.032 . . . . 0.0 109.483 179.046 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.575 HG21 ' CG1' ' A' ' 5' ' ' VAL . 5.8 p -143.85 138.1 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.612 0 C-N-CA 118.883 -1.127 . . . . 0.0 111.774 -178.909 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 -179.22 3.94 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 115.978 -0.555 . . . . 0.0 109.899 179.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 4.6 p -128.33 155.67 44.29 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.214 -0.929 . . . . 0.0 110.124 179.821 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.34 -178.31 41.09 Favored Glycine 0 N--CA 1.491 2.354 0 N-CA-C 109.899 -1.28 . . . . 0.0 109.899 -179.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 96.9 m-85 -147.5 133.34 19.04 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.396 -1.061 . . . . 0.0 109.909 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.628 ' HG2' HD11 ' B' ' 4' ' ' ILE . 5.0 mtm -118.66 -179.91 3.94 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.242 -0.911 . . . . 0.0 110.55 -179.845 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' B' ' 76' ' ' THR . 21.6 p -142.41 110.15 5.81 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.307 -0.871 . . . . 0.0 109.973 179.862 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 13.1 tt . . . . . 0 N--CA 1.492 1.633 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.301 -179.767 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.625 0 CA-C-O 121.157 0.503 . . . . 0.0 110.215 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 6.3 m -70.47 121.78 84.51 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.255 -0.903 . . . . 0.0 110.057 -179.892 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.522 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 47.3 Cg_endo -68.84 156.63 64.78 Favored 'Trans proline' 0 C--N 1.304 -1.798 0 O-C-N 124.149 1.605 . . . . 0.0 110.512 -179.95 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.628 HD11 ' HG2' ' A' ' 79' ' ' MET . 5.1 pt -142.5 168.9 13.57 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.349 -0.844 . . . . 0.0 109.887 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.617 HG12 HG21 ' B' ' 74' ' ' VAL . 5.3 t -145.76 124.97 5.58 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 O-C-N 121.206 -0.934 . . . . 0.0 110.269 -179.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.494 ' O ' HG23 ' B' ' 74' ' ' VAL . 0.0 OUTLIER -105.64 119.17 38.44 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.215 -0.928 . . . . 0.0 110.341 -179.877 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.73 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.3 mp -116.56 147.32 41.95 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.3 -0.875 . . . . 0.0 110.198 179.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 1.061 ' O ' HD12 ' B' ' 72' ' ' ILE . 11.6 tttt -142.4 168.71 19.08 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.342 -0.848 . . . . 0.0 110.439 -179.613 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.434 ' N ' ' CG ' ' B' ' 8' ' ' LYS . . . 151.61 -165.96 30.65 Favored Glycine 0 N--CA 1.491 2.363 0 N-CA-C 109.669 -1.372 . . . . 0.0 109.669 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . 0.486 ' O ' ' HG ' ' B' ' 14' ' ' LEU . 0.4 OUTLIER -64.97 130.84 44.86 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.289 -1.124 . . . . 0.0 110.196 -179.889 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.28 -38.79 42.97 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.312 -0.868 . . . . 0.0 110.67 -179.771 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 36.4 m-20 -66.56 -47.1 73.86 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.185 -0.947 . . . . 0.0 110.515 -179.672 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.478 ' O ' HD13 ' B' ' 17' ' ' LEU . 7.1 m -58.01 -28.32 64.33 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.21 -0.931 . . . . 0.0 110.539 -179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.675 HD21 HD13 ' B' ' 72' ' ' ILE . 77.3 mt -77.37 -26.95 52.37 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.137 -0.977 . . . . 0.0 110.358 -179.775 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 24.4 ttmt -59.36 -39.67 84.01 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.194 -0.941 . . . . 0.0 110.343 -179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.487 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 0.8 OUTLIER -70.2 -34.22 72.67 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.216 -0.927 . . . . 0.0 110.367 -179.895 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.478 HD13 ' O ' ' B' ' 13' ' ' THR . 6.1 mp -58.8 -51.66 69.04 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.131 -0.98 . . . . 0.0 110.466 -179.822 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.487 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 1.3 ttp-105 -46.16 -32.36 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.229 -0.92 . . . . 0.0 110.098 179.953 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.487 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 48.8 t80 -64.91 -33.25 75.56 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.287 -0.883 . . . . 0.0 110.504 -179.865 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 2.9 mtp85 -74.53 -30.19 61.68 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.264 -0.897 . . . . 0.0 110.503 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 11.3 m-30 -66.51 -21.58 66.17 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.208 -0.932 . . . . 0.0 110.459 -179.867 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . 0.416 ' CE ' ' HB2' ' A' ' 40' ' ' HIS . 29.2 mmtp -63.5 -36.24 83.1 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.255 -0.903 . . . . 0.0 110.592 -179.744 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 69.6 mmtt -75.12 -40.94 59.48 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.218 -0.926 . . . . 0.0 110.411 -179.716 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.621 ' HB3' HD12 ' B' ' 27' ' ' LEU . 15.8 m-70 -95.07 36.28 1.22 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.189 -0.944 . . . . 0.0 110.464 -179.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.593 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 31.8 p -57.38 -17.84 14.71 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.133 -0.98 . . . . 0.0 110.485 -179.905 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -96.92 -3.28 42.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.111 -0.993 . . . . 0.0 110.396 -179.769 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.621 HD12 ' HB3' ' B' ' 24' ' ' HIS . 10.9 mt -92.32 -6.22 50.69 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.556 -179.813 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.593 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 20.7 p90 -145.04 -178.09 5.87 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.202 -0.936 . . . . 0.0 109.635 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 48.0 m -96.44 -69.19 0.77 Allowed 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.91 -1.119 . . . . 0.0 110.589 -179.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.74 148.46 20.99 Favored 'General case' 0 C--N 1.305 -1.339 0 O-C-N 120.955 -1.091 . . . . 0.0 109.065 -179.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.678 ' O ' HG13 ' B' ' 31' ' ' VAL . 14.3 p -91.37 113.32 26.75 Favored 'Isoleucine or valine' 0 C--N 1.291 -1.938 0 O-C-N 121.712 -0.617 . . . . 0.0 110.39 179.907 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.443 ' OG ' ' HB ' ' B' ' 50' ' ' THR . 70.7 p -53.08 152.55 4.09 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.006 -1.059 . . . . 0.0 109.56 179.404 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . 0.483 ' OG ' ' HB2' ' A' ' 35' ' ' TRP . 0.9 OUTLIER -60.77 154.45 21.73 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.014 -1.054 . . . . 0.0 109.98 -179.82 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 2.7 m -67.63 130.23 42.38 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.26 -0.9 . . . . 0.0 110.161 -179.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.453 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 44.1 p-90 -146.09 176.04 10.02 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.313 -0.867 . . . . 0.0 109.929 -179.843 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.484 ' HB2' ' HA ' ' B' ' 47' ' ' ALA . 53.7 t-80 -162.55 178.05 8.92 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.159 -0.963 . . . . 0.0 110.427 -179.577 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.476 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 79.6 m95 -78.5 123.78 27.43 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.276 -0.89 . . . . 0.0 110.067 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 1.7 m -171.87 159.44 5.17 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.32 -0.863 . . . . 0.0 109.869 -179.868 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.7 -125.7 2.69 Favored Glycine 0 N--CA 1.489 2.189 0 N-CA-C 109.483 -1.447 . . . . 0.0 109.483 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . 0.472 ' CB ' ' HE2' ' A' ' 22' ' ' LYS . 28.7 t-80 -91.44 -39.73 11.81 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.297 -1.119 . . . . 0.0 110.243 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 8.1 t-20 -135.45 66.73 1.51 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.162 -0.961 . . . . 0.0 110.102 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.521 HG12 ' N ' ' B' ' 43' ' ' LYS . 43.5 t -121.56 170.57 11.5 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 121.268 -0.895 . . . . 0.0 110.123 -179.946 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.521 ' N ' HG12 ' B' ' 42' ' ' VAL . 33.0 mtpt -94.1 176.86 6.17 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.271 -0.893 . . . . 0.0 110.237 179.934 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 53.7 t60 -114.82 136.31 53.23 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.287 -0.883 . . . . 0.0 110.045 179.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -110.37 -70.2 0.82 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.15 -0.968 . . . . 0.0 110.48 -179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.507 ' O ' HG13 ' B' ' 48' ' ' ILE . 0.2 OUTLIER -154.16 106.41 2.8 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.159 -0.963 . . . . 0.0 110.434 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.485 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -40.51 157.76 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.448 -0.782 . . . . 0.0 110.008 179.87 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.73 HG23 ' O ' ' B' ' 7' ' ' LEU . 70.2 mt -142.12 144.29 25.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.517 0 O-C-N 121.18 -0.95 . . . . 0.0 110.318 -179.486 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.542 HG12 ' N ' ' B' ' 50' ' ' THR . 70.8 t -116.65 169.16 7.34 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.334 -0.854 . . . . 0.0 110.498 -179.798 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.542 ' N ' HG12 ' B' ' 49' ' ' VAL . 17.2 m -146.04 152.96 40.19 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.295 -0.878 . . . . 0.0 109.804 179.832 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -136.01 128.47 30.43 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.132 -0.98 . . . . 0.0 110.232 179.986 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.417 ' OG1' ' CZ3' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -97.28 134.93 39.92 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.332 -0.855 . . . . 0.0 110.208 179.963 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.541 ' CD2' ' HA ' ' B' ' 59' ' ' ARG . 38.3 m-85 -112.31 147.69 35.79 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.264 -0.898 . . . . 0.0 110.034 179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -93.45 -3.18 53.55 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.252 -0.905 . . . . 0.0 110.822 -179.575 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . 0.413 ' OG ' ' HB2' ' B' ' 58' ' ' GLN . 98.8 p -157.44 121.38 4.2 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.015 -1.053 . . . . 0.0 110.372 -179.874 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.479 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 2.3 mt-10 -46.99 -42.18 17.55 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.314 -0.867 . . . . 0.0 109.978 179.883 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . 0.429 ' CD1' ' NE2' ' B' ' 61' ' ' GLN . 16.1 t-105 -53.94 -55.83 23.38 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.267 -0.895 . . . . 0.0 110.119 179.824 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.413 ' HB2' ' OG ' ' B' ' 55' ' ' SER . 17.1 tt0 -59.23 -31.06 68.71 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.408 -0.807 . . . . 0.0 110.52 -179.955 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.541 ' HA ' ' CD2' ' B' ' 53' ' ' TYR . 0.0 OUTLIER -59.41 -54.7 43.73 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.18 -0.95 . . . . 0.0 110.96 -179.645 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . 0.418 ' O ' ' CB ' ' B' ' 64' ' ' SER . 19.6 t70 -61.12 -31.3 71.01 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.174 -0.954 . . . . 0.0 110.893 -179.071 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.442 ' O ' ' CG ' ' B' ' 65' ' ' GLN . 51.3 mt-30 -65.76 -46.55 78.39 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.116 -0.99 . . . . 0.0 110.668 -179.59 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.705 ' O ' HG12 ' B' ' 66' ' ' VAL . 41.5 t80 -56.43 -67.84 0.27 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.242 -0.911 . . . . 0.0 111.04 -179.691 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.615 ' C ' HD12 ' B' ' 63' ' ' LEU . 4.1 pp -59.14 -12.93 5.78 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.306 -0.872 . . . . 0.0 110.792 -179.094 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.418 ' CB ' ' O ' ' B' ' 60' ' ' ASP . 11.2 t -88.46 -23.36 23.29 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.172 -0.955 . . . . 0.0 109.901 179.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . 0.442 ' CG ' ' O ' ' B' ' 61' ' ' GLN . 3.5 mm-40 -98.2 -44.63 6.51 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.444 -0.785 . . . . 0.0 110.02 179.762 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.705 HG12 ' O ' ' B' ' 62' ' ' PHE . 1.9 p -98.12 90.9 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.359 -0.838 . . . . 0.0 110.008 179.747 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.456 ' C ' HG12 ' B' ' 68' ' ' ILE . 19.0 pttp -64.48 -176.88 0.26 Allowed 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.413 -0.804 . . . . 0.0 110.48 -179.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.919 HG22 ' HD2' ' B' ' 69' ' ' PRO . 0.1 OUTLIER -151.44 149.93 25.55 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.405 -0.809 . . . . 0.0 109.682 -179.847 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.919 ' HD2' HG22 ' B' ' 68' ' ' ILE . 45.3 Cg_endo -49.35 -178.05 0.01 OUTLIER 'Trans proline' 0 C--N 1.306 -1.695 0 O-C-N 123.779 1.41 . . . . 0.0 110.655 -179.715 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -96.01 -4.0 43.93 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.288 -0.882 . . . . 0.0 110.581 -179.784 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -84.63 -23.29 29.6 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.151 -0.968 . . . . 0.0 110.078 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 1.061 HD12 ' O ' ' B' ' 8' ' ' LYS . 1.9 tp -94.47 106.59 18.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.372 -0.83 . . . . 0.0 110.112 179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 26.8 m -97.35 156.06 16.62 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.044 -1.035 . . . . 0.0 109.408 179.021 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.617 HG21 HG12 ' B' ' 5' ' ' VAL . 6.0 p -143.91 138.39 24.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 C-N-CA 118.85 -1.14 . . . . 0.0 111.63 -178.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.98 -179.37 3.98 Favored 'General case' 0 N--CA 1.491 1.601 0 CA-C-N 115.96 -0.564 . . . . 0.0 110.009 179.63 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . 0.436 ' O ' ' OG ' ' A' ' 80' ' ' SER . 5.5 p -128.19 155.46 44.47 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.222 -0.924 . . . . 0.0 110.01 179.782 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -170.72 -178.32 41.31 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.854 -1.298 . . . . 0.0 109.854 -179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -147.5 133.52 19.24 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.336 -1.097 . . . . 0.0 110.05 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.605 ' HG2' HD11 ' A' ' 4' ' ' ILE . 5.0 mtm -118.81 179.74 4.05 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.341 -0.85 . . . . 0.0 110.323 -179.849 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 21.6 p -142.07 110.17 5.91 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.379 -0.825 . . . . 0.0 109.88 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.402 HG22 ' H ' ' B' ' 81' ' ' ILE . 13.8 tt . . . . . 0 N--CA 1.491 1.612 0 CA-C-O 117.949 -1.024 . . . . 0.0 110.384 -179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 91.4 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.222 0.534 . . . . 0.0 110.078 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -70.43 142.65 89.51 Favored Pre-proline 0 N--CA 1.491 1.601 0 O-C-N 121.262 -0.899 . . . . 0.0 110.107 179.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.46 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 45.3 Cg_endo -92.5 137.22 1.6 Allowed 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 123.97 1.511 . . . . 0.0 110.227 179.936 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.527 HG21 ' SD ' ' A' ' 79' ' ' MET . 1.0 OUTLIER -142.8 176.05 3.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 O-C-N 121.389 -0.819 . . . . 0.0 109.861 179.917 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.557 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 12.4 p -146.11 153.69 13.19 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.526 0 O-C-N 121.199 -0.938 . . . . 0.0 110.466 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.591 ' HD2' HG23 ' A' ' 50' ' ' THR . 0.2 OUTLIER -133.75 108.89 8.77 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.481 -0.762 . . . . 0.0 109.765 179.932 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.656 ' O ' HG23 ' A' ' 48' ' ' ILE . 2.4 pp -120.89 162.44 19.83 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.252 -0.905 . . . . 0.0 110.685 -179.685 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.598 ' O ' HG23 ' A' ' 72' ' ' ILE . 31.3 pttt -139.58 166.4 24.7 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.317 -0.864 . . . . 0.0 110.22 -179.24 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 167.11 178.72 39.65 Favored Glycine 0 N--CA 1.491 2.308 0 N-CA-C 109.682 -1.367 . . . . 0.0 109.682 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -65.34 136.4 56.48 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.304 -1.116 . . . . 0.0 110.508 -179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.08 -24.43 2.7 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.232 -0.917 . . . . 0.0 110.18 179.764 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -81.37 -51.38 8.41 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.3 -0.875 . . . . 0.0 110.143 -179.971 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 19.8 m -57.86 -16.73 12.76 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.286 -0.883 . . . . 0.0 109.905 -179.922 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 15.7 mt -90.89 -28.98 17.77 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.36 -0.838 . . . . 0.0 110.135 179.881 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -60.19 -48.83 80.06 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.277 -0.889 . . . . 0.0 110.675 -179.755 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 31.2 t -70.02 -34.91 73.89 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.204 -0.935 . . . . 0.0 110.763 -179.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.73 -48.1 82.34 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.148 -0.97 . . . . 0.0 110.56 -179.752 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.66 ' CZ ' ' CD2' ' B' ' 40' ' ' HIS . 72.0 ttt-85 -47.69 -32.51 5.82 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.229 -0.919 . . . . 0.0 110.648 -179.905 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 63.9 t80 -64.12 -25.81 68.26 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.204 -0.935 . . . . 0.0 109.945 -179.589 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 86.0 mtt180 -73.68 -32.93 64.21 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.206 -0.934 . . . . 0.0 109.631 179.407 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.57 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 7.2 m-30 -66.72 -8.19 26.27 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.37 -0.831 . . . . 0.0 110.191 179.643 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 33.7 mmtt -63.06 -49.82 73.03 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.157 -0.965 . . . . 0.0 109.856 -179.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.2 mmtt -75.29 -25.93 58.33 Favored 'General case' 0 N--CA 1.489 1.492 0 O-C-N 121.248 -0.907 . . . . 0.0 109.772 179.582 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.472 ' HA ' HD13 ' A' ' 27' ' ' LEU . 18.1 m170 -95.27 29.61 2.45 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.377 -0.827 . . . . 0.0 110.018 179.831 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . . . . . . . . . 9.3 p -57.26 -19.59 22.58 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.111 -0.993 . . . . 0.0 110.177 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 7.7 t -97.09 9.32 42.43 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.207 -0.933 . . . . 0.0 110.267 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.472 HD13 ' HA ' ' A' ' 24' ' ' HIS . 4.2 mp -92.38 -33.07 14.72 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.123 -0.986 . . . . 0.0 110.628 -179.799 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 43.5 p90 -118.76 168.88 10.33 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.964 -1.085 . . . . 0.0 110.255 179.802 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.67 -31.59 11.49 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.219 -0.925 . . . . 0.0 110.745 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.571 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.77 116.23 2.52 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.152 -0.967 . . . . 0.0 110.582 -179.903 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.767 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.3 p -90.11 101.57 12.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.627 0 O-C-N 121.157 -0.964 . . . . 0.0 110.268 179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.609 ' HB2' ' CE3' ' B' ' 35' ' ' TRP . 54.9 p -50.41 153.02 1.67 Allowed 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.135 -0.978 . . . . 0.0 110.484 -179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.573 ' HB3' HG21 ' B' ' 42' ' ' VAL . 91.5 p -61.27 -96.43 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.274 -0.891 . . . . 0.0 110.506 -179.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.471 ' N ' ' OG ' ' A' ' 33' ' ' SER . 3.2 m -171.55 125.19 0.6 Allowed 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.414 -0.804 . . . . 0.0 110.036 -179.775 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.56 ' CE3' ' HB2' ' B' ' 32' ' ' SER . 33.6 p-90 -147.09 -168.61 3.09 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.374 -0.829 . . . . 0.0 110.053 179.868 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.767 ' HB3' HG11 ' A' ' 42' ' ' VAL . 82.6 t60 -162.64 171.14 17.35 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.26 -0.9 . . . . 0.0 110.183 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.505 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 4.4 m95 -79.85 99.11 7.37 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.15 -0.969 . . . . 0.0 110.054 179.705 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.983 HG21 ' HA ' ' A' ' 42' ' ' VAL . 2.3 m -170.14 -87.19 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.362 -0.836 . . . . 0.0 110.013 -179.999 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.795 ' N ' HG22 ' A' ' 38' ' ' THR . . . 158.92 -130.61 2.54 Favored Glycine 0 N--CA 1.489 2.216 0 N-CA-C 110.033 -1.227 . . . . 0.0 110.033 179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . 0.612 ' CD2' ' CZ ' ' B' ' 18' ' ' ARG . 7.0 p80 -68.79 -40.18 79.76 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.376 -1.073 . . . . 0.0 110.326 -179.658 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.639 ' O ' HG21 ' A' ' 38' ' ' THR . 24.0 t-20 -109.44 98.86 8.18 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.453 -0.78 . . . . 0.0 109.964 179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.983 ' HA ' HG21 ' A' ' 38' ' ' THR . 42.5 t -98.15 107.48 20.32 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.303 -0.873 . . . . 0.0 110.533 -179.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.486 ' HD3' ' OD1' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -153.81 38.25 0.47 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.316 -0.865 . . . . 0.0 110.405 179.902 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 21.4 m170 -110.91 -69.35 0.87 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.176 -0.952 . . . . 0.0 110.264 179.949 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.619 ' HB2' ' CE1' ' A' ' 36' ' ' HIS . 0.3 OUTLIER -98.32 -156.64 0.55 Allowed 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.236 -0.915 . . . . 0.0 110.354 -179.896 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.447 ' O ' ' O ' ' A' ' 47' ' ' ALA . 2.8 t -97.0 134.4 40.41 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.035 -1.041 . . . . 0.0 110.954 -179.546 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.539 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -41.55 163.53 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.479 -0.763 . . . . 0.0 110.168 179.8 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.656 HG23 ' O ' ' A' ' 7' ' ' LEU . 64.4 mt -142.42 162.13 18.92 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.471 0 O-C-N 121.177 -0.952 . . . . 0.0 110.102 -179.262 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 4.6 t -135.95 167.98 23.61 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.255 -0.903 . . . . 0.0 110.702 -179.464 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.591 HG23 ' HD2' ' A' ' 6' ' ' HIS . 82.9 m -145.99 153.81 41.19 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.319 -0.863 . . . . 0.0 109.603 179.674 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.557 ' HB2' ' CG1' ' A' ' 5' ' ' VAL . 0.5 OUTLIER -136.33 136.04 39.37 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.045 -1.035 . . . . 0.0 110.219 179.858 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.571 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 0.0 OUTLIER -96.61 125.28 40.96 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.332 -0.855 . . . . 0.0 110.444 -179.79 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.46 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 38.1 m-85 -108.83 147.37 32.2 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.325 -0.859 . . . . 0.0 110.133 179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 6.2 m-20 -95.37 -16.92 22.0 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.191 -0.943 . . . . 0.0 110.3 179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -140.26 126.84 20.28 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.184 -0.947 . . . . 0.0 110.296 179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 4.3 mt-10 -53.99 -42.97 69.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.244 -0.91 . . . . 0.0 110.23 -179.938 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 25.1 t-105 -53.58 -48.31 69.33 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.253 -0.904 . . . . 0.0 109.848 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.7 tt0 -58.84 -36.31 74.36 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.371 -0.831 . . . . 0.0 110.088 179.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.773 ' NH2' HG22 ' A' ' 76' ' ' THR . 2.2 tmt_? -59.45 -45.51 91.4 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.398 -0.814 . . . . 0.0 110.827 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -60.99 -38.25 85.36 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.137 -0.977 . . . . 0.0 110.674 -179.326 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 -65.51 -39.23 91.6 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 121.154 -0.966 . . . . 0.0 110.53 -179.668 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.708 ' O ' HG22 ' A' ' 66' ' ' VAL . 30.5 t80 -56.24 -65.2 0.65 Allowed 'General case' 0 N--CA 1.493 1.725 0 O-C-N 121.356 -0.84 . . . . 0.0 111.036 -179.723 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.739 HD12 ' C ' ' A' ' 63' ' ' LEU . 4.6 pp -59.64 -10.31 3.47 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.221 -0.924 . . . . 0.0 110.841 -179.224 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . 0.512 ' N ' HD12 ' A' ' 63' ' ' LEU . 4.5 t -92.41 -23.61 19.13 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.098 -1.001 . . . . 0.0 110.699 -179.691 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 7.9 mm100 -95.5 -28.25 14.98 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.077 -1.015 . . . . 0.0 110.716 -179.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.708 HG22 ' O ' ' A' ' 62' ' ' PHE . 3.5 m -109.37 75.07 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.044 -1.035 . . . . 0.0 110.138 179.795 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 8.9 ttpp -50.83 111.57 0.57 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.288 -0.882 . . . . 0.0 110.229 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.499 HG23 ' HB ' ' A' ' 72' ' ' ILE . 0.5 OUTLIER -87.62 139.28 31.47 Favored Pre-proline 0 N--CA 1.489 1.478 0 O-C-N 121.178 -0.951 . . . . 0.0 110.065 -179.647 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 68' ' ' ILE . 46.2 Cg_endo -56.5 179.01 0.11 Allowed 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.211 1.637 . . . . 0.0 110.56 -179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 6.7 pttt -86.36 -0.62 56.3 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.338 -0.851 . . . . 0.0 110.195 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.0 p -84.42 -30.5 25.28 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.282 -0.886 . . . . 0.0 109.765 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.598 HG23 ' O ' ' A' ' 8' ' ' LYS . 50.8 mt -94.34 114.76 31.61 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 O-C-N 121.45 -0.781 . . . . 0.0 110.013 179.642 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.539 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 7.0 m -95.53 146.08 24.71 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.195 -0.941 . . . . 0.0 109.933 179.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.526 ' CG2' ' CG2' ' A' ' 5' ' ' VAL . 8.2 p -145.2 154.32 13.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.628 0 O-C-N 121.129 -0.982 . . . . 0.0 110.749 -179.45 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.99 -179.23 5.84 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.579 -0.701 . . . . 0.0 109.876 -179.899 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.773 HG22 ' NH2' ' A' ' 59' ' ' ARG . 52.4 p -107.09 163.81 12.68 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.228 -0.92 . . . . 0.0 110.381 -179.801 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -165.45 -177.86 38.11 Favored Glycine 0 N--CA 1.491 2.35 0 N-CA-C 109.411 -1.475 . . . . 0.0 109.411 179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -147.9 144.15 27.88 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.201 -1.176 . . . . 0.0 110.333 -179.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.527 ' SD ' HG21 ' A' ' 4' ' ' ILE . 97.2 mtp -115.29 172.46 7.07 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.265 -0.897 . . . . 0.0 110.147 179.933 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.473 ' HB3' ' O ' ' B' ' 76' ' ' THR . 2.2 t -132.72 101.76 5.41 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.202 -0.937 . . . . 0.0 110.483 -179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.41 HG23 ' O ' ' A' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.721 0 CA-C-O 118.016 -0.992 . . . . 0.0 110.126 179.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mtp . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 121.246 0.546 . . . . 0.0 110.127 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -69.97 143.81 92.22 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.266 -0.896 . . . . 0.0 110.27 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.462 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 46.3 Cg_endo -93.4 137.14 1.29 Allowed 'Trans proline' 0 C--N 1.304 -1.785 0 O-C-N 124.03 1.542 . . . . 0.0 110.362 -179.927 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.507 HG21 ' SD ' ' B' ' 79' ' ' MET . 1.0 OUTLIER -143.13 176.73 3.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.739 0 O-C-N 121.391 -0.818 . . . . 0.0 110.025 179.826 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 74' ' ' VAL . 12.3 p -146.44 154.04 12.69 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.193 -0.942 . . . . 0.0 110.413 179.713 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.566 ' HD2' HG23 ' B' ' 50' ' ' THR . 0.2 OUTLIER -133.92 108.42 8.4 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.42 -0.8 . . . . 0.0 109.667 179.794 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.648 ' O ' HG23 ' B' ' 48' ' ' ILE . 2.5 pp -120.55 162.45 19.59 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.16 -0.963 . . . . 0.0 110.687 -179.541 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.616 ' O ' HG23 ' B' ' 72' ' ' ILE . 31.9 pttt -139.69 166.31 24.94 Favored 'General case' 0 N--CA 1.489 1.514 0 O-C-N 121.26 -0.9 . . . . 0.0 110.256 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 167.17 178.36 39.45 Favored Glycine 0 N--CA 1.491 2.362 0 N-CA-C 109.645 -1.382 . . . . 0.0 109.645 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 14.6 t0 -65.02 136.89 57.31 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.42 -1.047 . . . . 0.0 110.405 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.38 -25.13 3.53 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.325 -0.859 . . . . 0.0 110.117 179.777 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 77.5 m-20 -80.52 -51.61 8.57 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.317 -0.864 . . . . 0.0 110.188 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 18.6 m -57.87 -16.54 12.14 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.248 -0.907 . . . . 0.0 110.041 179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 16.6 mt -91.16 -28.74 17.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.372 -0.83 . . . . 0.0 110.237 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 18.0 ttmt -60.15 -48.67 80.76 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.29 -0.881 . . . . 0.0 110.638 -179.818 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 28.0 t -70.15 -34.98 73.7 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.172 -0.955 . . . . 0.0 110.865 -179.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 2.6 mp -58.65 -48.12 82.14 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.064 -1.023 . . . . 0.0 110.505 -179.561 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.612 ' CZ ' ' CD2' ' A' ' 40' ' ' HIS . 71.4 ttt-85 -47.63 -32.64 5.78 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.329 -0.857 . . . . 0.0 110.593 179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 64.7 t80 -64.28 -25.17 67.93 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.128 -0.982 . . . . 0.0 109.953 -179.577 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -74.69 -32.71 62.27 Favored 'General case' 0 N--CA 1.489 1.481 0 O-C-N 121.318 -0.864 . . . . 0.0 109.5 179.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.573 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 7.5 m-30 -66.65 -8.17 25.65 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.37 -0.831 . . . . 0.0 110.117 179.655 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 35.2 mmtt -63.14 -50.09 71.82 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.211 -0.931 . . . . 0.0 109.932 -179.839 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 5.5 mmtt -75.14 -25.74 58.62 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.226 -0.921 . . . . 0.0 109.779 179.609 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.489 ' O ' ' HB2' ' B' ' 27' ' ' LEU . 18.1 m170 -95.34 29.34 2.55 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.366 -0.834 . . . . 0.0 110.14 179.862 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . . . . . . . . . 14.3 p -57.04 -19.73 20.6 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.104 -0.997 . . . . 0.0 110.208 -179.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 7.3 t -97.06 9.54 41.82 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.339 -0.851 . . . . 0.0 110.209 179.983 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.489 ' HB2' ' O ' ' B' ' 24' ' ' HIS . 4.2 mp -92.31 -34.13 14.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.22 -0.925 . . . . 0.0 110.564 -179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . . . . . . . . . 42.6 p90 -117.9 168.92 10.06 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.005 -1.06 . . . . 0.0 110.417 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 2.8 m -99.71 -31.48 11.53 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.312 -0.867 . . . . 0.0 110.828 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.589 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.67 116.47 2.58 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.054 -1.029 . . . . 0.0 110.58 -179.979 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.778 ' O ' HG13 ' B' ' 31' ' ' VAL . 12.0 p -90.27 101.12 11.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.116 -0.99 . . . . 0.0 110.333 179.763 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.56 ' HB2' ' CE3' ' A' ' 35' ' ' TRP . 60.0 p -50.38 152.51 1.82 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.081 -1.012 . . . . 0.0 110.376 179.958 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . 0.514 ' OG ' ' N ' ' B' ' 34' ' ' THR . 85.6 p -61.23 -95.93 0.0 OUTLIER 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.884 . . . . 0.0 110.5 -179.937 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.514 ' N ' ' OG ' ' B' ' 33' ' ' SER . 3.2 m -171.64 125.45 0.59 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.461 -0.774 . . . . 0.0 110.054 -179.806 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.609 ' CE3' ' HB2' ' A' ' 32' ' ' SER . 36.1 p-90 -147.11 -168.77 3.13 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.375 -0.828 . . . . 0.0 110.075 179.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.767 ' HB3' HG11 ' B' ' 42' ' ' VAL . 82.2 t60 -162.58 170.77 18.03 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.146 -0.971 . . . . 0.0 110.079 -179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.498 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 4.5 m95 -79.91 98.34 7.09 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.112 -0.992 . . . . 0.0 110.154 179.798 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.987 HG21 ' HA ' ' B' ' 42' ' ' VAL . 2.3 m -169.38 -85.18 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.326 -0.859 . . . . 0.0 110.189 179.966 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . 0.754 ' N ' HG22 ' B' ' 38' ' ' THR . . . 157.42 -130.67 2.68 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 109.89 -1.284 . . . . 0.0 109.89 179.839 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . 0.66 ' CD2' ' CZ ' ' A' ' 18' ' ' ARG . 6.8 p80 -69.44 -39.29 77.88 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.333 -1.098 . . . . 0.0 110.531 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . 0.606 ' O ' HG21 ' B' ' 38' ' ' THR . 22.0 t-20 -110.22 97.18 6.71 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.279 -0.888 . . . . 0.0 110.055 -179.94 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.987 ' HA ' HG21 ' B' ' 38' ' ' THR . 42.3 t -96.41 108.92 22.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.184 -0.948 . . . . 0.0 110.449 -179.634 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.474 ' HD3' ' OD1' ' B' ' 41' ' ' ASN . 0.2 OUTLIER -155.87 39.57 0.37 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.323 -0.861 . . . . 0.0 110.021 179.903 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 22.0 m170 -111.94 -69.15 0.88 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.25 -0.906 . . . . 0.0 110.121 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . 0.617 ' HB2' ' CE1' ' B' ' 36' ' ' HIS . 0.3 OUTLIER -99.13 -156.59 0.55 Allowed 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.286 -0.884 . . . . 0.0 110.138 179.933 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.44 ' O ' ' O ' ' B' ' 47' ' ' ALA . 2.8 t -97.46 134.83 40.18 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.106 -0.996 . . . . 0.0 110.869 -179.442 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.532 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -41.9 163.57 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.473 -0.767 . . . . 0.0 110.277 179.949 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.648 HG23 ' O ' ' B' ' 7' ' ' LEU . 64.2 mt -142.38 162.43 18.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 O-C-N 121.227 -0.921 . . . . 0.0 110.12 -179.135 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 4.9 t -136.49 168.05 22.92 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.098 -1.001 . . . . 0.0 110.725 -179.613 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.566 HG23 ' HD2' ' B' ' 6' ' ' HIS . 78.4 m -145.94 153.87 41.29 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.439 -0.788 . . . . 0.0 109.677 179.739 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.544 ' HB2' ' CG1' ' B' ' 5' ' ' VAL . 0.5 OUTLIER -136.52 135.89 38.89 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.08 -1.013 . . . . 0.0 110.295 -179.909 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.589 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 0.0 OUTLIER -96.59 124.98 40.75 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.226 -0.921 . . . . 0.0 110.505 -179.821 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.462 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 40.5 m-85 -108.71 147.46 31.92 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.344 -0.848 . . . . 0.0 110.076 179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -95.29 -17.66 21.47 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.094 -1.004 . . . . 0.0 110.273 179.967 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.6 m -139.22 127.33 22.47 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.177 -0.952 . . . . 0.0 110.403 179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 4.2 mt-10 -54.37 -42.63 70.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 110.264 179.959 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 25.6 t-105 -53.7 -48.45 69.55 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.209 -0.932 . . . . 0.0 109.89 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 49.6 tt0 -58.94 -36.04 74.12 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.343 -0.848 . . . . 0.0 110.098 179.878 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.776 ' NH2' HG22 ' B' ' 76' ' ' THR . 1.8 tmt_? -59.2 -45.73 90.32 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.345 -0.847 . . . . 0.0 110.915 -179.762 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 21.4 t0 -61.02 -37.94 84.34 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.027 -1.046 . . . . 0.0 110.774 -179.349 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -65.67 -38.96 90.77 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.15 -0.968 . . . . 0.0 110.448 -179.73 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.711 ' O ' HG22 ' B' ' 66' ' ' VAL . 31.4 t80 -56.25 -65.17 0.65 Allowed 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.227 -0.921 . . . . 0.0 110.987 -179.783 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.733 ' C ' HD12 ' B' ' 63' ' ' LEU . 4.6 pp -59.59 -11.54 5.0 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.292 -0.88 . . . . 0.0 110.951 -179.351 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . 0.526 ' N ' HD12 ' B' ' 63' ' ' LEU . 4.8 t -91.11 -23.48 20.28 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.014 -1.054 . . . . 0.0 110.663 -179.502 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -95.57 -28.58 14.78 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.093 -1.005 . . . . 0.0 110.769 -179.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.711 HG22 ' O ' ' B' ' 62' ' ' PHE . 3.5 m -109.02 74.28 0.36 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.095 -1.003 . . . . 0.0 110.231 179.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 10.3 ttpp -50.12 111.67 0.56 Allowed 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.382 -0.823 . . . . 0.0 110.108 179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.496 HG23 ' HB ' ' B' ' 72' ' ' ILE . 0.5 OUTLIER -87.67 139.56 31.41 Favored Pre-proline 0 N--CA 1.492 1.636 0 O-C-N 121.085 -1.01 . . . . 0.0 110.035 -179.638 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.445 ' HD2' HG23 ' B' ' 68' ' ' ILE . 47.3 Cg_endo -56.85 178.92 0.12 Allowed 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 124.156 1.608 . . . . 0.0 110.518 -179.823 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -86.07 -0.8 56.47 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.179 -0.951 . . . . 0.0 110.297 -179.906 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 58.8 p -84.41 -30.29 25.47 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.19 -0.944 . . . . 0.0 109.7 179.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.616 HG23 ' O ' ' B' ' 8' ' ' LYS . 47.9 mt -94.51 114.68 31.6 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 O-C-N 121.394 -0.816 . . . . 0.0 110.079 179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . 0.54 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.0 m -95.42 146.23 24.56 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.177 -0.952 . . . . 0.0 110.002 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.555 ' CG2' ' CG2' ' B' ' 5' ' ' VAL . 8.4 p -145.22 154.34 13.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.159 -0.963 . . . . 0.0 110.857 -179.374 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -140.43 -179.5 6.05 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.493 -0.754 . . . . 0.0 109.89 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . 0.776 HG22 ' NH2' ' B' ' 59' ' ' ARG . 54.2 p -106.73 163.87 12.56 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.196 -0.94 . . . . 0.0 110.344 -179.918 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -165.47 -177.52 37.87 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.241 -1.544 . . . . 0.0 109.241 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 79.1 m-85 -148.24 144.23 27.53 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.151 -1.205 . . . . 0.0 110.347 179.993 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.507 ' SD ' HG21 ' B' ' 4' ' ' ILE . 96.6 mtp -115.18 172.95 6.76 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.283 -0.885 . . . . 0.0 110.108 179.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.412 ' O ' HG23 ' B' ' 81' ' ' ILE . 2.2 t -133.21 102.36 5.54 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.18 -0.95 . . . . 0.0 110.312 -179.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.412 HG23 ' O ' ' B' ' 80' ' ' SER . 2.0 pt . . . . . 0 N--CA 1.493 1.695 0 CA-C-O 117.97 -1.014 . . . . 0.0 110.07 179.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.4 mmm . . . . . 0 N--CA 1.494 1.753 0 CA-C-O 121.306 0.574 . . . . 0.0 110.195 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.522 ' O ' ' CG ' ' A' ' 79' ' ' MET . 0.3 OUTLIER -103.14 101.31 21.2 Favored Pre-proline 0 N--CA 1.491 1.597 0 O-C-N 121.169 -0.957 . . . . 0.0 110.186 179.992 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.503 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -56.37 164.42 5.42 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.904 1.476 . . . . 0.0 110.243 -179.846 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' A' ' 77' ' ' GLY . 1.3 pt -144.01 125.39 10.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.56 0 O-C-N 121.172 -0.955 . . . . 0.0 110.187 179.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.542 ' CG1' ' HB2' ' A' ' 51' ' ' LEU . 5.6 p -94.34 132.56 38.05 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.556 0 O-C-N 121.211 -0.931 . . . . 0.0 110.246 -179.883 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.579 ' CB ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -105.28 126.23 51.87 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.262 -0.899 . . . . 0.0 109.876 179.767 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.894 ' CD1' HG23 ' A' ' 72' ' ' ILE . 13.0 tp -115.01 133.65 55.86 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.16 -0.962 . . . . 0.0 110.714 -179.548 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.521 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 9.1 tttt -141.15 166.38 24.94 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.335 -0.853 . . . . 0.0 109.974 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.521 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.32 -171.55 32.22 Favored Glycine 0 N--CA 1.492 2.388 0 N-CA-C 109.751 -1.339 . . . . 0.0 109.751 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -65.0 136.08 56.38 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.232 -1.158 . . . . 0.0 110.39 -179.959 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.537 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.81 -48.41 59.71 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.303 -0.873 . . . . 0.0 110.652 -179.946 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.8 -56.17 13.37 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.082 -1.011 . . . . 0.0 110.487 -179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 4.4 m -58.19 -26.0 62.26 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.164 -0.96 . . . . 0.0 110.786 -179.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.816 ' HA ' HD12 ' A' ' 17' ' ' LEU . 56.1 mt -71.86 -31.89 66.92 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.117 -0.989 . . . . 0.0 110.379 -179.749 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 2.1 ttmt -59.69 -42.7 93.53 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.216 -0.928 . . . . 0.0 110.567 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 6.8 t -70.4 -37.53 74.5 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.212 -0.93 . . . . 0.0 111.002 -179.598 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.816 HD12 ' HA ' ' A' ' 14' ' ' LEU . 42.8 mt -58.8 -55.44 35.1 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.071 -1.018 . . . . 0.0 110.594 -179.535 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 36.1 ttp85 -45.59 -21.55 0.11 Allowed 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.241 -0.912 . . . . 0.0 110.919 -179.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' A' ' 17' ' ' LEU . 67.0 t80 -64.41 -59.33 4.47 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.083 -1.011 . . . . 0.0 110.678 -179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 47.5 mtt-85 -68.16 -14.72 63.19 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.206 -0.934 . . . . 0.0 110.417 -179.757 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.62 -41.05 88.98 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.253 -0.904 . . . . 0.0 110.573 -179.873 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp -63.51 -25.13 68.11 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.171 -0.955 . . . . 0.0 110.668 -179.528 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.9 mmtt -75.28 -38.66 60.28 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.153 -0.967 . . . . 0.0 110.575 -179.701 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.877 ' HB3' HD12 ' A' ' 27' ' ' LEU . 23.1 m-70 -94.73 45.25 1.11 Allowed 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.251 -0.906 . . . . 0.0 110.399 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.604 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 20.0 p -57.32 -16.1 7.93 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.349 -0.844 . . . . 0.0 110.229 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.573 HG23 ' SG ' ' A' ' 25' ' ' CYS . 65.3 p -96.85 3.62 52.11 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.261 -0.899 . . . . 0.0 110.454 -179.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.877 HD12 ' HB3' ' A' ' 24' ' ' HIS . 8.0 mt -91.75 -26.28 18.66 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.214 -0.929 . . . . 0.0 110.137 179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.604 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 44.0 p90 -122.13 174.22 7.08 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.158 -0.964 . . . . 0.0 109.936 179.356 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 25.6 m -101.0 -36.36 9.05 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.118 -0.989 . . . . 0.0 111.949 -179.034 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.493 ' O ' ' CZ3' ' B' ' 37' ' ' TRP . . . -160.51 123.99 3.47 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.855 -1.153 . . . . 0.0 110.941 -179.896 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.614 ' O ' HG13 ' A' ' 31' ' ' VAL . 8.5 p -89.62 120.46 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.613 0 O-C-N 121.176 -0.952 . . . . 0.0 110.049 179.406 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.64 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 4.4 p -84.21 150.18 25.64 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.321 -0.862 . . . . 0.0 110.953 -179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.39 158.52 14.4 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.103 -0.998 . . . . 0.0 109.523 179.306 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 19.5 m -67.77 134.58 51.24 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.021 -1.049 . . . . 0.0 109.962 179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.668 ' CD2' ' O ' ' A' ' 35' ' ' TRP . 46.9 p-90 -145.49 120.7 10.18 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.106 -0.996 . . . . 0.0 109.917 179.957 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.885 ' CD2' HG22 ' A' ' 38' ' ' THR . 0.3 OUTLIER -79.02 161.29 26.71 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.212 -0.93 . . . . 0.0 110.614 -179.709 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.585 ' CE3' ' HA ' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -78.62 55.5 1.66 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.206 -0.934 . . . . 0.0 109.929 179.761 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.885 HG22 ' CD2' ' A' ' 36' ' ' HIS . 6.0 t -148.3 -179.21 6.78 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.197 -0.939 . . . . 0.0 110.228 -179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.463 ' O ' HG23 ' A' ' 38' ' ' THR . . . -71.21 174.55 40.89 Favored Glycine 0 N--CA 1.49 2.295 0 N-CA-C 109.544 -1.422 . . . . 0.0 109.544 179.881 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 41.7 t60 -61.19 -63.36 1.32 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.236 -1.155 . . . . 0.0 110.192 -179.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -65.5 95.41 0.21 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.304 -0.873 . . . . 0.0 110.607 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.827 HG21 HG21 ' A' ' 38' ' ' THR . 12.7 p -150.16 156.57 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.215 -0.928 . . . . 0.0 110.13 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.44 ' O ' ' C ' ' A' ' 44' ' ' HIS . 1.2 mtpt -129.34 -26.0 2.61 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.214 -0.929 . . . . 0.0 110.553 -179.8 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.44 ' C ' ' O ' ' A' ' 43' ' ' LYS . 0.1 OUTLIER -41.55 148.62 0.14 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.242 -0.911 . . . . 0.0 110.276 -179.788 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.424 ' C ' ' OG ' ' A' ' 46' ' ' SER . 5.3 tttm -68.18 114.62 6.83 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.242 -0.911 . . . . 0.0 110.338 -179.77 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.424 ' OG ' ' C ' ' A' ' 45' ' ' LYS . 1.3 m -162.61 148.94 12.77 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.314 -0.866 . . . . 0.0 109.85 179.84 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -175.87 125.16 0.21 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.151 -0.968 . . . . 0.0 110.118 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.813 HG23 ' O ' ' A' ' 7' ' ' LEU . 25.9 mt -141.5 140.97 30.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.162 -0.961 . . . . 0.0 110.599 -179.78 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.447 HG12 HD11 ' A' ' 51' ' ' LEU . 48.5 t -121.94 117.81 53.58 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.386 -0.821 . . . . 0.0 109.933 179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.766 ' C ' HD12 ' A' ' 51' ' ' LEU . 39.2 m -94.15 154.63 17.48 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.192 -0.943 . . . . 0.0 110.49 -179.688 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.766 HD12 ' C ' ' A' ' 50' ' ' THR . 5.6 mp -135.91 134.72 39.01 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.234 -0.916 . . . . 0.0 109.889 179.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.527 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -96.85 127.49 42.88 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.324 -0.86 . . . . 0.0 110.757 -179.44 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.503 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 15.9 m-85 -109.13 147.84 31.82 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.459 -0.775 . . . . 0.0 109.976 179.763 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 72.9 m-20 -88.22 -10.09 50.87 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.23 -0.919 . . . . 0.0 110.765 -179.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.19 132.42 10.01 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.116 -0.99 . . . . 0.0 110.319 -179.974 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.462 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 30.1 mm-40 -54.47 -38.15 66.07 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.304 -0.873 . . . . 0.0 110.054 179.862 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 72.9 t-105 -53.65 -53.54 50.52 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.178 -0.951 . . . . 0.0 110.025 179.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 27.6 tt0 -57.07 -27.23 61.54 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.421 -0.8 . . . . 0.0 110.256 -179.231 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.462 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 25.0 ttt-85 -59.62 -49.57 77.23 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.182 -0.949 . . . . 0.0 110.257 179.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 1.6 t70 -61.37 -33.09 73.07 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.364 -0.835 . . . . 0.0 110.914 -179.484 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -65.19 -49.59 69.18 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.988 -1.07 . . . . 0.0 110.158 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.867 ' CE2' HG21 ' A' ' 66' ' ' VAL . 0.6 OUTLIER -55.4 -41.43 72.69 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.214 -0.929 . . . . 0.0 109.639 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.492 HD23 HD11 ' A' ' 68' ' ' ILE . 2.6 mt -59.77 -24.61 64.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.426 -0.796 . . . . 0.0 110.374 179.813 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 26.7 p -91.77 -19.01 23.04 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.165 -0.959 . . . . 0.0 110.32 -179.965 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.74 -17.26 20.4 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.21 -0.931 . . . . 0.0 110.141 -179.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.867 HG21 ' CE2' ' A' ' 62' ' ' PHE . 30.9 t -102.17 97.46 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.319 -0.863 . . . . 0.0 110.329 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.524 ' CD ' ' O ' ' A' ' 67' ' ' LYS . 0.0 OUTLIER -56.62 104.52 0.15 Allowed 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.224 -0.922 . . . . 0.0 110.15 179.889 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.609 HG23 ' HB ' ' A' ' 72' ' ' ILE . 7.0 mt -89.85 136.44 29.23 Favored Pre-proline 0 C--N 1.301 -1.504 0 O-C-N 121.185 -0.947 . . . . 0.0 110.278 179.68 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.548 ' HG2' HD13 ' A' ' 72' ' ' ILE . 45.8 Cg_endo -76.76 -158.64 0.09 OUTLIER 'Trans proline' 0 C--N 1.304 -1.79 0 O-C-N 124.034 1.544 . . . . 0.0 110.214 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.525 ' O ' HG23 ' A' ' 71' ' ' THR . 39.0 mttp -100.92 45.38 0.97 Allowed 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.109 -0.994 . . . . 0.0 110.491 -179.893 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.525 HG23 ' O ' ' A' ' 70' ' ' LYS . 0.7 OUTLIER -154.69 -10.87 0.13 Allowed 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.063 -1.023 . . . . 0.0 112.1 -179.772 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.894 HG23 ' CD1' ' A' ' 7' ' ' LEU . 1.2 mp -94.2 113.74 29.43 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 O-C-N 120.596 -1.315 . . . . 0.0 109.962 179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 30.5 m -95.59 144.38 26.09 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.104 -0.997 . . . . 0.0 110.449 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.461 HG12 ' N ' ' A' ' 75' ' ' SER . 24.7 t -90.15 167.09 1.72 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.241 -0.912 . . . . 0.0 111.085 -178.889 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.579 ' HB2' ' CB ' ' A' ' 6' ' ' HIS . 1.2 m -144.39 164.45 30.79 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.671 -0.643 . . . . 0.0 110.895 179.604 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 20.7 p -133.93 156.22 48.52 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.438 -0.788 . . . . 0.0 109.282 179.04 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' A' ' 4' ' ' ILE . . . 176.11 138.58 2.9 Favored Glycine 0 N--CA 1.491 2.311 0 N-CA-C 109.671 -1.372 . . . . 0.0 109.671 -179.99 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 10.2 m-85 -92.57 140.56 29.43 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.129 -1.218 . . . . 0.0 110.255 179.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.614 ' CE ' HD12 ' A' ' 81' ' ' ILE . 2.8 ppp? -126.91 168.55 14.35 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.138 -0.976 . . . . 0.0 110.309 179.967 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.485 ' O ' HG13 ' A' ' 81' ' ' ILE . 0.5 OUTLIER -148.86 108.97 4.09 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.243 -0.91 . . . . 0.0 110.25 179.884 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.614 HD12 ' CE ' ' A' ' 79' ' ' MET . 27.7 mt . . . . . 0 N--CA 1.492 1.666 0 CA-C-O 118.065 -0.969 . . . . 0.0 110.194 179.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.4 ' HE3' ' HB3' ' B' ' 1' ' ' MET . 3.2 mmm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.278 0.561 . . . . 0.0 110.133 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.546 ' O ' ' CG ' ' B' ' 79' ' ' MET . 0.3 OUTLIER -102.84 100.52 16.86 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.216 -0.927 . . . . 0.0 110.285 -179.954 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.3 Cg_endo -55.5 164.58 4.01 Favored 'Trans proline' 0 C--N 1.305 -1.758 0 O-C-N 123.974 1.513 . . . . 0.0 110.325 -179.977 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.53 ' CG1' ' O ' ' B' ' 77' ' ' GLY . 1.3 pt -144.29 125.1 8.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.203 -0.936 . . . . 0.0 110.227 179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.536 ' CG1' ' HB2' ' B' ' 51' ' ' LEU . 5.5 p -94.23 132.41 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.13 -0.981 . . . . 0.0 110.303 -179.822 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.584 ' CB ' ' HB2' ' B' ' 75' ' ' SER . 0.0 OUTLIER -105.07 126.5 52.14 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.284 -0.885 . . . . 0.0 109.9 179.875 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.889 ' CD1' HG23 ' B' ' 72' ' ' ILE . 13.4 tp -115.34 133.57 55.91 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.089 -1.007 . . . . 0.0 110.591 -179.62 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.532 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 8.7 tttt -141.2 166.47 24.68 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.326 -0.859 . . . . 0.0 109.885 179.97 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.532 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.53 -171.28 32.36 Favored Glycine 0 N--CA 1.491 2.333 0 N-CA-C 109.742 -1.343 . . . . 0.0 109.742 -179.917 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -64.96 136.27 56.62 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.36 -1.083 . . . . 0.0 110.354 -179.921 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.528 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.7 -49.38 57.67 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.382 -0.823 . . . . 0.0 110.607 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -50.11 -56.13 12.15 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.221 -0.925 . . . . 0.0 110.704 -179.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 4.2 m -58.0 -26.85 62.91 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.182 -0.949 . . . . 0.0 110.846 -179.581 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.835 ' HA ' HD12 ' B' ' 17' ' ' LEU . 60.1 mt -70.98 -31.86 68.53 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.104 -0.998 . . . . 0.0 110.52 -179.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 2.2 ttmt -59.75 -42.66 93.69 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.225 -0.922 . . . . 0.0 110.625 -179.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 6.0 t -70.17 -37.32 75.15 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.195 -0.941 . . . . 0.0 110.837 -179.65 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.835 HD12 ' HA ' ' B' ' 14' ' ' LEU . 48.7 mt -58.8 -55.81 30.35 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.252 -0.905 . . . . 0.0 110.708 -179.51 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 35.7 ttp85 -45.75 -21.16 0.1 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.282 -0.886 . . . . 0.0 110.88 -179.679 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.4 ' N ' ' O ' ' B' ' 17' ' ' LEU . 67.2 t80 -64.58 -60.18 3.42 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.025 -1.047 . . . . 0.0 110.527 -179.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 48.2 mtt-85 -67.48 -14.73 63.19 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.165 -0.96 . . . . 0.0 110.473 -179.805 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.2 m-85 -66.64 -40.83 88.87 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.193 -0.942 . . . . 0.0 110.585 -179.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 20.4 mmtp -63.37 -25.45 68.3 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.26 -0.9 . . . . 0.0 110.677 -179.646 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 mmtt -75.18 -39.04 60.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.166 -0.959 . . . . 0.0 110.574 -179.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.864 ' HB3' HD12 ' B' ' 27' ' ' LEU . 23.9 m-70 -94.35 45.12 1.12 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.083 -1.011 . . . . 0.0 110.276 -179.718 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.623 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 20.9 p -57.14 -15.91 6.61 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.249 -0.907 . . . . 0.0 110.212 179.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.575 HG23 ' SG ' ' B' ' 25' ' ' CYS . 80.4 p -96.86 3.09 52.37 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.325 -0.859 . . . . 0.0 110.446 -179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.864 HD12 ' HB3' ' B' ' 24' ' ' HIS . 8.2 mt -91.75 -25.64 18.96 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.124 -0.985 . . . . 0.0 110.158 179.907 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.623 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 44.5 p90 -122.5 173.82 7.44 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.147 -0.971 . . . . 0.0 109.958 179.434 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 25.4 m -100.69 -36.13 9.23 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.986 -1.071 . . . . 0.0 111.742 -178.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.485 ' O ' ' CZ3' ' A' ' 37' ' ' TRP . . . -160.68 123.93 3.38 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.845 -1.159 . . . . 0.0 111.059 -179.697 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.615 ' O ' HG13 ' B' ' 31' ' ' VAL . 8.7 p -89.47 119.95 37.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.161 -0.962 . . . . 0.0 110.037 179.331 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.644 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 3.9 p -83.92 150.82 25.43 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.298 -0.876 . . . . 0.0 110.832 -179.385 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -61.45 158.81 13.95 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.027 -1.045 . . . . 0.0 109.734 179.337 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 19.0 m -68.01 134.76 51.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.028 -1.045 . . . . 0.0 109.899 179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.664 ' O ' ' CD2' ' B' ' 35' ' ' TRP . 46.1 p-90 -145.83 120.6 9.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.101 -1.0 . . . . 0.0 109.937 -179.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.846 ' CD2' HG22 ' B' ' 38' ' ' THR . 0.3 OUTLIER -78.94 161.3 26.78 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.235 -0.915 . . . . 0.0 110.593 -179.646 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.588 ' HA ' ' CE3' ' B' ' 37' ' ' TRP . 0.0 OUTLIER -78.65 53.48 1.34 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.259 -0.9 . . . . 0.0 110.165 -179.835 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.874 HG21 HG21 ' B' ' 42' ' ' VAL . 6.6 t -146.53 -179.41 6.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.246 -0.909 . . . . 0.0 110.363 -179.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . 0.459 ' O ' HG23 ' B' ' 38' ' ' THR . . . -69.6 175.32 33.93 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 109.511 -1.436 . . . . 0.0 109.511 179.698 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 43.7 t60 -62.32 -63.05 1.35 Allowed 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.206 -1.173 . . . . 0.0 110.107 -179.968 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 18.2 t-20 -65.59 96.89 0.28 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.373 -0.829 . . . . 0.0 110.253 179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.874 HG21 HG21 ' B' ' 38' ' ' THR . 12.7 p -151.44 155.08 7.41 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.353 -0.842 . . . . 0.0 110.071 179.75 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.443 ' O ' ' C ' ' B' ' 44' ' ' HIS . 1.3 mtpt -128.09 -26.15 2.91 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.161 -0.962 . . . . 0.0 110.635 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . 0.443 ' C ' ' O ' ' B' ' 43' ' ' LYS . 0.1 OUTLIER -41.33 149.16 0.11 Allowed 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.242 -0.911 . . . . 0.0 110.314 -179.714 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . 0.427 ' C ' ' OG ' ' B' ' 46' ' ' SER . 5.6 tttm -68.74 114.71 7.34 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.275 -0.891 . . . . 0.0 110.442 -179.671 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.427 ' OG ' ' C ' ' B' ' 45' ' ' LYS . 1.3 m -162.55 149.47 13.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.276 -0.89 . . . . 0.0 110.083 179.951 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.42 ' HB2' ' O ' ' B' ' 46' ' ' SER . . . -176.52 125.36 0.18 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.177 -0.952 . . . . 0.0 110.286 179.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.831 HG23 ' O ' ' B' ' 7' ' ' LEU . 40.8 mt -141.87 140.99 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.71 0 O-C-N 121.2 -0.937 . . . . 0.0 110.617 -179.725 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.463 HG12 HD11 ' B' ' 51' ' ' LEU . 48.1 t -121.67 117.81 53.74 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.608 0 O-C-N 121.333 -0.854 . . . . 0.0 109.943 179.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.765 ' C ' HD12 ' B' ' 51' ' ' LEU . 34.9 m -93.95 154.32 17.74 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.287 -0.883 . . . . 0.0 110.374 -179.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.765 HD12 ' C ' ' B' ' 50' ' ' THR . 5.7 mp -135.81 134.78 39.27 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.297 -0.877 . . . . 0.0 109.804 179.621 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.514 ' OG1' ' CH2' ' A' ' 37' ' ' TRP . 0.0 OUTLIER -96.84 127.59 42.97 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.286 -0.883 . . . . 0.0 110.627 -179.542 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.496 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 16.1 m-85 -109.43 148.02 31.85 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.449 -0.782 . . . . 0.0 109.737 179.631 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -88.25 -9.73 51.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.131 -0.981 . . . . 0.0 110.725 -179.407 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -156.07 133.01 10.51 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.164 -0.96 . . . . 0.0 110.344 -179.953 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.464 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 28.5 mm-40 -55.31 -38.34 68.54 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.3 -0.875 . . . . 0.0 109.984 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 73.3 t-105 -53.57 -53.29 53.86 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.34 -0.85 . . . . 0.0 109.884 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 27.1 tt0 -56.72 -27.99 60.15 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.382 -0.824 . . . . 0.0 110.143 -179.406 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.464 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 24.0 ttt-85 -59.54 -49.17 78.8 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.19 -0.944 . . . . 0.0 110.395 179.655 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 1.3 t70 -61.47 -33.02 73.05 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.242 -0.911 . . . . 0.0 110.899 -179.604 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 30.2 mt-30 -65.37 -49.85 67.74 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.152 -0.968 . . . . 0.0 110.063 -179.663 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.881 ' CE2' HG21 ' B' ' 66' ' ' VAL . 0.6 OUTLIER -55.52 -41.11 72.69 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.275 -0.891 . . . . 0.0 109.642 179.67 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.497 HD23 ' CD1' ' B' ' 68' ' ' ILE . 2.6 mt -59.75 -25.58 64.98 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.413 -0.804 . . . . 0.0 110.178 179.754 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 26.0 p -90.48 -19.5 23.78 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.27 -0.894 . . . . 0.0 110.62 -179.76 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -96.83 -17.1 20.42 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.26 -0.9 . . . . 0.0 110.225 -179.934 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.881 HG21 ' CE2' ' B' ' 62' ' ' PHE . 34.8 t -102.04 96.94 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.211 -0.931 . . . . 0.0 110.374 -179.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . 0.526 ' CD ' ' O ' ' B' ' 67' ' ' LYS . 0.0 OUTLIER -56.13 104.32 0.13 Allowed 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.197 -0.939 . . . . 0.0 110.254 179.872 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.595 HG23 ' HB ' ' B' ' 72' ' ' ILE . 6.8 mt -89.88 136.88 28.66 Favored Pre-proline 0 N--CA 1.49 1.548 0 O-C-N 121.227 -0.92 . . . . 0.0 110.251 179.544 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.553 ' HG2' HD13 ' B' ' 72' ' ' ILE . 46.7 Cg_endo -77.19 -157.82 0.08 OUTLIER 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.127 1.593 . . . . 0.0 110.296 179.908 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.513 ' O ' HG23 ' B' ' 71' ' ' THR . 39.3 mttp -101.5 45.24 0.98 Allowed 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.198 -0.939 . . . . 0.0 110.368 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . 0.513 HG23 ' O ' ' B' ' 70' ' ' LYS . 0.7 OUTLIER -154.76 -10.72 0.13 Allowed 'General case' 0 N--CA 1.497 1.894 0 O-C-N 121.094 -1.004 . . . . 0.0 112.04 -179.745 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.889 HG23 ' CD1' ' B' ' 7' ' ' LEU . 1.2 mp -94.38 113.84 29.78 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 O-C-N 120.553 -1.342 . . . . 0.0 109.971 179.835 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 32.0 m -95.44 144.24 26.12 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.037 -1.039 . . . . 0.0 110.351 -179.977 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.468 HG12 ' N ' ' B' ' 75' ' ' SER . 24.1 t -90.13 167.14 1.71 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.251 -0.905 . . . . 0.0 111.084 -178.865 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . 0.584 ' HB2' ' CB ' ' B' ' 6' ' ' HIS . 1.3 m -144.59 163.72 33.06 Favored 'General case' 0 N--CA 1.492 1.638 0 CA-C-O 121.409 0.623 . . . . 0.0 110.955 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 22.3 p -133.13 156.91 46.59 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.5 -0.75 . . . . 0.0 109.222 179.1 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.53 ' O ' ' CG1' ' B' ' 4' ' ' ILE . . . 175.69 138.72 2.89 Favored Glycine 0 N--CA 1.492 2.379 0 N-CA-C 109.583 -1.407 . . . . 0.0 109.583 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -92.71 140.63 29.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.074 -1.251 . . . . 0.0 110.243 179.837 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.586 ' CE ' HD12 ' B' ' 81' ' ' ILE . 2.7 ppp? -126.55 169.38 13.13 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.115 -0.991 . . . . 0.0 110.19 179.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.48 ' O ' HG13 ' B' ' 81' ' ' ILE . 0.5 OUTLIER -149.95 108.77 3.86 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.216 -0.928 . . . . 0.0 110.127 179.932 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.586 HD12 ' CE ' ' B' ' 79' ' ' MET . 27.0 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.993 -1.003 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.686 ' HE2' ' CD2' ' A' ' 78' ' ' PHE . 1.8 mtp . . . . . 0 N--CA 1.493 1.706 0 CA-C-O 121.116 0.484 . . . . 0.0 110.094 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 16.8 p -98.79 122.34 53.27 Favored Pre-proline 0 N--CA 1.491 1.619 0 O-C-N 121.133 -0.979 . . . . 0.0 110.734 -179.65 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.531 ' HG2' ' HB2' ' A' ' 53' ' ' TYR . 46.7 Cg_endo -80.41 164.04 21.65 Favored 'Trans proline' 0 C--N 1.306 -1.679 0 O-C-N 124.023 1.538 . . . . 0.0 109.716 179.355 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.437 ' O ' HG13 ' A' ' 4' ' ' ILE . 4.7 pt -143.26 124.0 10.4 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.712 0 O-C-N 121.07 -1.018 . . . . 0.0 110.755 -179.599 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.593 ' O ' HG13 ' A' ' 5' ' ' VAL . 11.2 p -95.14 124.68 47.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.705 0 O-C-N 121.441 -0.787 . . . . 0.0 110.353 179.698 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.495 ' O ' ' HB2' ' A' ' 75' ' ' SER . 0.0 OUTLIER -107.24 127.57 53.65 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.154 -0.966 . . . . 0.0 110.272 179.755 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.802 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.7 OUTLIER -129.29 153.58 47.68 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.06 -1.025 . . . . 0.0 110.507 179.925 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.493 ' HG2' ' N ' ' A' ' 9' ' ' GLY . 1.2 ttpm? -141.85 169.8 16.91 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.179 -0.951 . . . . 0.0 110.2 179.91 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.493 ' N ' ' HG2' ' A' ' 8' ' ' LYS . . . 153.22 -175.46 31.66 Favored Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.581 -1.408 . . . . 0.0 109.581 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -65.05 146.47 54.96 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.371 -1.076 . . . . 0.0 110.549 -179.868 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.959 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.42 -48.64 56.11 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.343 -0.848 . . . . 0.0 110.421 179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.435 ' OD1' ' N ' ' A' ' 12' ' ' ASN . 3.3 m120 -53.93 -48.87 69.78 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.156 -0.965 . . . . 0.0 110.678 -179.586 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.476 HG21 ' OG1' ' A' ' 71' ' ' THR . 0.2 OUTLIER -58.27 -20.61 43.84 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.239 -0.913 . . . . 0.0 110.98 -179.604 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.959 HD12 ' HA ' ' A' ' 11' ' ' ALA . 51.5 mt -75.61 -39.41 57.94 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.059 -1.025 . . . . 0.0 110.607 -179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 1.2 ttmt -60.29 -26.39 66.48 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.154 -0.966 . . . . 0.0 110.505 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.52 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 29.1 t -69.94 -54.01 15.27 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.285 -0.885 . . . . 0.0 110.843 -179.245 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.588 HD11 HG13 ' A' ' 72' ' ' ILE . 42.2 mt -59.19 -53.19 61.13 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.048 -1.033 . . . . 0.0 110.566 -179.592 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.451 ' O ' ' HG3' ' A' ' 18' ' ' ARG . 0.3 OUTLIER -46.63 -25.63 0.75 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.422 -0.799 . . . . 0.0 111.271 -179.443 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.52 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 39.1 t80 -64.85 -39.95 94.37 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 120.968 -1.082 . . . . 0.0 110.514 -179.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.26 -23.76 60.37 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.514 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.531 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 10.3 m-30 -66.42 -27.94 68.23 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.167 -0.958 . . . . 0.0 110.346 -179.755 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 27.8 mmtt -63.58 -42.46 98.31 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.238 -0.914 . . . . 0.0 110.151 179.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 12.9 mmtm -75.12 -40.35 59.92 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.323 -0.861 . . . . 0.0 110.353 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.412 ' HB3' HD22 ' A' ' 27' ' ' LEU . 41.5 m-70 -94.91 39.63 1.1 Allowed 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.228 -0.92 . . . . 0.0 110.446 -179.815 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.502 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 10.1 p -57.5 -14.69 5.4 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.267 -0.896 . . . . 0.0 110.593 179.92 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 29.8 p -96.77 3.97 52.02 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.144 -0.972 . . . . 0.0 110.403 -179.826 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.412 HD22 ' HB3' ' A' ' 24' ' ' HIS . 3.3 mp -92.28 -22.89 19.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.234 -0.916 . . . . 0.0 110.434 -179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.502 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 37.4 p90 -130.06 -177.1 4.16 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.191 -0.943 . . . . 0.0 109.799 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 63.9 m -95.67 -64.23 1.08 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.016 -1.052 . . . . 0.0 110.333 -179.461 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.52 145.5 18.97 Favored 'General case' 0 C--N 1.305 -1.33 0 O-C-N 120.785 -1.197 . . . . 0.0 109.126 -179.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.669 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.4 p -91.77 102.6 13.69 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.634 -0.666 . . . . 0.0 110.418 179.688 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.47 ' HB3' ' CZ3' ' B' ' 35' ' ' TRP . 2.6 p -52.35 154.52 2.42 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.08 -1.013 . . . . 0.0 109.598 179.608 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 1.9 p -60.56 158.77 11.7 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.146 -0.971 . . . . 0.0 110.07 -179.771 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 4.5 m -67.54 126.25 28.75 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.205 -0.934 . . . . 0.0 110.142 -179.89 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.502 ' CE3' ' N ' ' A' ' 36' ' ' HIS . 32.7 p-90 -146.24 173.27 12.38 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.283 -0.886 . . . . 0.0 109.987 -179.981 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.502 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 4.9 t60 -162.72 -178.26 6.06 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.125 -0.984 . . . . 0.0 110.687 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 48.8 m95 -79.37 92.37 5.18 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.469 -0.769 . . . . 0.0 110.158 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.497 HG21 HG11 ' A' ' 42' ' ' VAL . 72.6 p -127.55 -142.2 0.27 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.291 -0.881 . . . . 0.0 110.399 -179.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -168.46 -52.63 0.03 OUTLIER Glycine 0 N--CA 1.491 2.305 0 N-CA-C 109.311 -1.516 . . . . 0.0 109.311 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 22.5 t-160 -159.67 -61.99 0.07 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.36 -1.083 . . . . 0.0 110.028 179.827 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -78.21 108.8 11.78 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.307 -0.87 . . . . 0.0 109.954 179.791 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.497 HG11 HG21 ' A' ' 38' ' ' THR . 0.1 OUTLIER -131.51 135.49 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.186 -0.946 . . . . 0.0 109.975 -179.851 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.524 ' HD3' ' CG ' ' A' ' 44' ' ' HIS . 4.4 tttt -150.54 -38.8 0.13 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.248 -0.908 . . . . 0.0 110.199 -179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.598 ' O ' ' CD2' ' A' ' 44' ' ' HIS . 0.5 OUTLIER -147.48 94.89 2.44 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.2 -0.937 . . . . 0.0 110.303 179.774 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -138.19 177.76 7.64 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.15 -0.969 . . . . 0.0 110.144 179.917 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.563 ' O ' HG13 ' A' ' 48' ' ' ILE . 0.1 OUTLIER -83.31 73.53 10.13 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.191 -0.943 . . . . 0.0 110.311 -179.961 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.403 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -45.7 154.66 0.2 Allowed 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.462 -0.774 . . . . 0.0 110.52 -179.731 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.802 HG23 ' O ' ' A' ' 7' ' ' LEU . 58.0 mt -145.92 150.33 15.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.484 0 O-C-N 121.333 -0.855 . . . . 0.0 110.435 179.49 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 2.1 t -122.71 170.38 13.02 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.273 -0.892 . . . . 0.0 109.805 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.444 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 60.9 m -145.76 156.58 43.69 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.199 -0.938 . . . . 0.0 110.065 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 2.2 mp -136.24 133.11 36.68 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.223 -0.923 . . . . 0.0 110.31 -179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.503 ' OG1' ' CH2' ' B' ' 37' ' ' TRP . 18.5 m -96.81 130.57 44.05 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.361 -0.837 . . . . 0.0 110.219 -179.918 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.542 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 11.7 m-85 -110.43 147.99 32.94 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.178 -0.951 . . . . 0.0 109.987 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 26.6 m-20 -78.9 -3.42 44.67 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.145 -0.972 . . . . 0.0 110.669 -179.448 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -170.49 139.65 1.67 Allowed 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.124 -0.985 . . . . 0.0 110.266 -179.872 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -56.63 -31.93 64.82 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.248 -0.907 . . . . 0.0 109.785 179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 16.5 t-105 -55.05 -59.74 4.33 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.325 -0.859 . . . . 0.0 110.606 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -57.31 -36.76 71.5 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.238 -0.913 . . . . 0.0 111.152 -178.657 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 49.1 ttp85 -59.26 -40.98 87.74 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.984 -1.072 . . . . 0.0 110.512 -179.873 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.54 -40.91 96.37 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.273 -0.892 . . . . 0.0 110.745 -179.701 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -65.66 -40.35 92.36 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.121 -0.987 . . . . 0.0 110.537 -179.535 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.625 ' CE2' HG21 ' A' ' 66' ' ' VAL . 9.4 t80 -55.45 -45.5 76.83 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.153 -0.967 . . . . 0.0 109.651 179.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.7 mt -59.55 -16.56 25.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.38 -0.825 . . . . 0.0 110.382 179.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.66 -22.73 19.27 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.12 -0.987 . . . . 0.0 110.309 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -95.51 -26.52 15.78 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.228 -0.92 . . . . 0.0 110.038 -179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.625 HG21 ' CE2' ' A' ' 62' ' ' PHE . 87.0 t -107.09 75.07 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.541 0 O-C-N 121.26 -0.9 . . . . 0.0 109.874 179.77 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.78 104.68 0.47 Allowed 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.197 -0.94 . . . . 0.0 109.886 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.621 HD12 ' H ' ' A' ' 68' ' ' ILE . 0.8 OUTLIER -88.51 134.92 33.26 Favored Pre-proline 0 N--CA 1.491 1.61 0 O-C-N 121.278 -0.889 . . . . 0.0 109.701 179.898 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.591 ' HD2' HG22 ' A' ' 68' ' ' ILE . 44.4 Cg_endo -54.77 -160.11 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.748 0 O-C-N 124.172 1.617 . . . . 0.0 110.561 -179.863 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.482 ' O ' ' HG2' ' A' ' 70' ' ' LYS . 28.1 tttm -95.47 2.98 54.65 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.14 -0.975 . . . . 0.0 110.907 -179.295 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.476 ' OG1' HG21 ' A' ' 13' ' ' THR . 4.5 p -85.24 -28.59 25.28 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.076 -1.015 . . . . 0.0 110.774 -179.842 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.588 HG13 HD11 ' A' ' 17' ' ' LEU . 12.8 mm -94.21 124.57 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.817 0 O-C-N 121.15 -0.969 . . . . 0.0 111.176 -179.01 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.49 ' O ' ' HA ' ' A' ' 7' ' ' LEU . 6.4 t -96.34 138.3 34.15 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.361 -0.837 . . . . 0.0 110.011 179.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -90.01 165.81 1.93 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 121.083 -1.011 . . . . 0.0 111.103 -178.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.495 ' HB2' ' O ' ' A' ' 6' ' ' HIS . 0.3 OUTLIER -142.23 155.43 45.26 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.607 -0.683 . . . . 0.0 110.524 179.858 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 10.6 p -133.67 134.15 42.76 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.288 -0.882 . . . . 0.0 110.339 179.457 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.49 -169.38 25.79 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 109.599 -1.401 . . . . 0.0 109.599 179.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.686 ' CD2' ' HE2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -148.07 150.86 34.66 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.378 -1.072 . . . . 0.0 110.165 -179.89 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.44 ' O ' ' HE3' ' A' ' 1' ' ' MET . 26.6 mtp -122.72 158.24 30.56 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.232 -0.918 . . . . 0.0 110.342 179.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.621 ' C ' HD12 ' A' ' 81' ' ' ILE . 0.2 OUTLIER -144.42 111.89 6.06 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.277 -0.889 . . . . 0.0 110.114 179.887 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.621 HD12 ' C ' ' A' ' 80' ' ' SER . 3.1 mp . . . . . 0 N--CA 1.492 1.639 0 CA-C-O 118.01 -0.995 . . . . 0.0 110.144 -179.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.663 ' HE2' ' CD2' ' B' ' 78' ' ' PHE . 1.7 mtp . . . . . 0 N--CA 1.493 1.692 0 CA-C-O 121.194 0.521 . . . . 0.0 110.033 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 17.6 p -98.52 122.55 53.12 Favored Pre-proline 0 N--CA 1.491 1.581 0 O-C-N 121.112 -0.993 . . . . 0.0 110.678 -179.724 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.538 ' HG2' ' HB2' ' B' ' 53' ' ' TYR . 46.4 Cg_endo -80.69 163.88 21.0 Favored 'Trans proline' 0 C--N 1.306 -1.705 0 O-C-N 123.982 1.517 . . . . 0.0 109.949 179.349 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.44 ' O ' HG13 ' B' ' 4' ' ' ILE . 4.9 pt -142.94 123.68 10.77 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.108 -0.995 . . . . 0.0 110.813 -179.54 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.593 ' O ' HG13 ' B' ' 5' ' ' VAL . 11.5 p -94.78 124.94 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.687 0 O-C-N 121.287 -0.883 . . . . 0.0 110.319 179.622 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.515 ' O ' ' HB2' ' B' ' 75' ' ' SER . 0.0 OUTLIER -107.07 127.16 53.23 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.197 -0.939 . . . . 0.0 110.192 179.719 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.814 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.7 OUTLIER -129.11 153.31 47.8 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.048 -1.032 . . . . 0.0 110.457 179.91 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.495 ' HG2' ' N ' ' B' ' 9' ' ' GLY . 1.2 ttpm? -142.05 169.95 16.63 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.285 -0.885 . . . . 0.0 110.192 179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.495 ' N ' ' HG2' ' B' ' 8' ' ' LYS . . . 153.04 -175.27 31.6 Favored Glycine 0 N--CA 1.49 2.288 0 N-CA-C 109.62 -1.392 . . . . 0.0 109.62 -179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -65.09 146.01 55.55 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.29 -1.124 . . . . 0.0 110.583 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.94 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.17 -47.05 54.66 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.389 -0.819 . . . . 0.0 110.631 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . 0.448 ' OD1' ' N ' ' B' ' 12' ' ' ASN . 3.1 m120 -56.05 -48.32 76.24 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.13 -0.981 . . . . 0.0 110.649 -179.498 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.487 HG21 ' OG1' ' B' ' 71' ' ' THR . 0.2 OUTLIER -58.15 -21.28 46.3 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.221 -0.924 . . . . 0.0 110.69 -179.563 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.94 HD12 ' HA ' ' B' ' 11' ' ' ALA . 54.5 mt -74.63 -39.81 61.88 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.99 -1.069 . . . . 0.0 110.647 -179.733 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 1.1 ttmt -60.48 -26.17 66.61 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.144 -0.973 . . . . 0.0 110.619 -179.845 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.532 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 29.4 t -69.81 -53.77 16.7 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.246 -0.909 . . . . 0.0 110.768 -179.546 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.583 HD11 HG13 ' B' ' 72' ' ' ILE . 39.8 mt -59.23 -53.55 56.95 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.16 -0.962 . . . . 0.0 110.616 -179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.448 ' O ' ' HG3' ' B' ' 18' ' ' ARG . 0.3 OUTLIER -46.47 -25.51 0.69 Allowed 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.315 -0.865 . . . . 0.0 111.154 -179.358 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.532 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 40.1 t80 -64.9 -40.35 94.95 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.004 -1.06 . . . . 0.0 110.458 -179.492 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.7 mtt85 -73.18 -23.53 60.44 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.141 -0.975 . . . . 0.0 110.584 -179.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.535 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 10.2 m-30 -66.37 -28.05 68.34 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.147 -0.971 . . . . 0.0 110.388 -179.767 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 27.6 mmtt -63.62 -42.21 98.21 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.282 -0.886 . . . . 0.0 110.185 179.946 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 12.7 mmtm -75.18 -40.41 59.44 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.327 -0.858 . . . . 0.0 110.313 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . . . . . . . . . 40.9 m-70 -95.05 39.78 1.11 Allowed 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.192 -0.943 . . . . 0.0 110.405 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.507 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 9.4 p -57.62 -14.83 5.97 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.335 -0.853 . . . . 0.0 110.361 179.889 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 29.9 p -96.65 3.91 52.21 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.219 -0.925 . . . . 0.0 110.303 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 mp -92.25 -23.17 19.41 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.236 -0.915 . . . . 0.0 110.364 -179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.507 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 39.9 p90 -129.6 -177.0 4.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.203 -0.936 . . . . 0.0 109.783 179.886 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -95.33 -64.55 1.05 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.065 -1.022 . . . . 0.0 110.294 -179.49 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.58 145.2 18.67 Favored 'General case' 0 C--N 1.305 -1.347 0 O-C-N 120.905 -1.122 . . . . 0.0 109.004 -179.528 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.653 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.7 p -91.77 102.66 13.75 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 O-C-N 121.74 -0.6 . . . . 0.0 110.471 179.794 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.476 ' HB3' ' CZ3' ' A' ' 35' ' ' TRP . 2.6 p -51.87 154.2 2.21 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.053 -1.029 . . . . 0.0 109.835 179.662 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 2.9 p -60.76 158.82 12.08 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.015 -1.053 . . . . 0.0 109.898 -179.933 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 4.4 m -67.71 126.63 30.0 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.303 -0.873 . . . . 0.0 110.231 -179.725 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.491 ' CE3' ' N ' ' B' ' 36' ' ' HIS . 33.4 p-90 -146.45 173.2 12.51 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.26 -0.9 . . . . 0.0 110.022 -179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.491 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 5.0 t60 -162.66 -178.45 6.2 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.149 -0.97 . . . . 0.0 110.655 -179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.503 ' CH2' ' OG1' ' A' ' 52' ' ' THR . 55.0 m95 -79.33 92.97 5.23 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.444 -0.785 . . . . 0.0 110.076 179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.494 HG21 HG11 ' B' ' 42' ' ' VAL . 70.7 p -127.58 -142.49 0.27 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.301 -0.874 . . . . 0.0 110.256 -179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -168.09 -51.48 0.03 OUTLIER Glycine 0 N--CA 1.49 2.272 0 N-CA-C 109.445 -1.462 . . . . 0.0 109.445 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 22.4 t-160 -161.09 -61.09 0.06 Allowed 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.322 -1.105 . . . . 0.0 110.019 179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -79.0 108.14 12.26 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.388 -0.82 . . . . 0.0 109.991 179.712 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.494 HG11 HG21 ' B' ' 38' ' ' THR . 0.1 OUTLIER -130.99 135.17 60.54 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.209 -0.932 . . . . 0.0 110.175 -179.649 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.52 ' HD3' ' CG ' ' B' ' 44' ' ' HIS . 4.4 tttt -150.1 -39.89 0.14 Allowed 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.29 -0.881 . . . . 0.0 110.134 179.929 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . 0.594 ' CD2' ' O ' ' B' ' 44' ' ' HIS . 0.5 OUTLIER -146.27 95.34 2.6 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.154 -0.966 . . . . 0.0 110.495 179.77 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 23.4 tptt -138.51 177.1 8.14 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.176 -0.952 . . . . 0.0 110.065 179.726 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.562 ' O ' HG13 ' B' ' 48' ' ' ILE . 0.1 OUTLIER -82.86 73.06 9.92 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.269 -0.894 . . . . 0.0 110.405 -179.819 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.407 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -45.08 154.9 0.13 Allowed 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.423 -0.798 . . . . 0.0 110.586 -179.591 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.814 HG23 ' O ' ' B' ' 7' ' ' LEU . 56.4 mt -145.99 150.05 15.75 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.348 -0.845 . . . . 0.0 110.376 179.499 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 2.1 t -122.79 170.13 13.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.216 -0.927 . . . . 0.0 109.857 179.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.402 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 73.3 m -145.46 156.53 43.8 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.158 -0.964 . . . . 0.0 110.14 -179.879 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 2.3 mp -136.23 133.65 37.27 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.277 -0.889 . . . . 0.0 110.197 180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 19.8 m -96.97 130.65 44.26 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.313 -0.867 . . . . 0.0 110.192 -179.947 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.538 ' HB2' ' HG2' ' B' ' 3' ' ' PRO . 16.3 m-85 -110.06 147.53 33.41 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.176 -0.953 . . . . 0.0 110.03 179.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -78.9 -2.95 42.34 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.241 -0.912 . . . . 0.0 110.727 -179.526 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -171.52 139.04 1.21 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.151 -0.968 . . . . 0.0 110.162 -179.87 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 14.0 mt-10 -56.22 -32.31 64.31 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.284 -0.885 . . . . 0.0 109.809 179.742 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 17.1 t-105 -54.7 -59.81 4.21 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.339 -0.851 . . . . 0.0 110.612 179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -57.16 -36.73 71.11 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.255 -0.903 . . . . 0.0 111.065 -178.627 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 48.5 ttp85 -59.16 -41.12 87.62 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 120.937 -1.102 . . . . 0.0 110.627 -179.981 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 3.1 t0 -61.28 -41.25 96.64 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.117 -0.99 . . . . 0.0 110.672 -179.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -65.46 -39.78 92.43 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.165 -0.959 . . . . 0.0 110.56 -179.513 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.607 ' CE2' HG21 ' B' ' 66' ' ' VAL . 10.1 t80 -55.59 -45.96 77.33 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.141 -0.974 . . . . 0.0 109.624 179.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.4 mt -59.72 -15.07 17.13 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.453 -0.78 . . . . 0.0 110.459 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -94.22 -22.95 18.09 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.122 -0.986 . . . . 0.0 110.068 -179.845 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -95.02 -26.6 16.0 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.267 -0.896 . . . . 0.0 109.886 -179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.607 HG21 ' CE2' ' B' ' 62' ' ' PHE . 89.8 t -107.17 75.55 0.41 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.229 -0.919 . . . . 0.0 110.106 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.08 104.79 0.51 Allowed 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.186 -0.946 . . . . 0.0 109.936 179.856 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.6 ' H ' HD12 ' B' ' 68' ' ' ILE . 0.8 OUTLIER -88.62 135.1 32.79 Favored Pre-proline 0 N--CA 1.492 1.664 0 O-C-N 121.287 -0.883 . . . . 0.0 109.834 179.882 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.579 ' HD2' HG22 ' B' ' 68' ' ' ILE . 43.7 Cg_endo -54.76 -160.67 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.052 1.554 . . . . 0.0 110.706 179.994 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.47 ' O ' ' HG2' ' B' ' 70' ' ' LYS . 29.7 tttm -94.66 2.6 55.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.193 -0.942 . . . . 0.0 110.837 -179.31 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . 0.487 ' OG1' HG21 ' B' ' 13' ' ' THR . 4.6 p -85.32 -28.64 25.11 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.12 -0.988 . . . . 0.0 110.972 -179.639 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.583 HG13 HD11 ' B' ' 17' ' ' LEU . 12.8 mm -94.32 124.36 46.77 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.806 0 O-C-N 121.143 -0.973 . . . . 0.0 111.035 -179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . 0.487 ' O ' ' HA ' ' B' ' 7' ' ' LEU . 6.3 t -96.18 138.54 33.64 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.215 -0.928 . . . . 0.0 110.001 179.291 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 2.9 t -89.87 166.25 1.86 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 O-C-N 121.067 -1.021 . . . . 0.0 111.053 -178.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . 0.515 ' HB2' ' O ' ' B' ' 6' ' ' HIS . 0.3 OUTLIER -142.67 155.29 44.89 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.647 -0.658 . . . . 0.0 110.427 179.844 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 9.2 p -133.3 134.26 43.63 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.185 -0.947 . . . . 0.0 110.223 179.5 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -162.07 -170.14 26.4 Favored Glycine 0 N--CA 1.491 2.34 0 N-CA-C 109.731 -1.348 . . . . 0.0 109.731 -179.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.663 ' CD2' ' HE2' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.86 150.24 33.77 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.234 -1.156 . . . . 0.0 110.129 179.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.419 ' O ' ' HB3' ' B' ' 1' ' ' MET . 24.5 mtp -122.18 157.76 30.86 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.259 -0.901 . . . . 0.0 110.344 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.624 ' C ' HD12 ' B' ' 81' ' ' ILE . 0.2 OUTLIER -144.41 112.21 6.23 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.26 -0.9 . . . . 0.0 109.921 179.812 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.655 ' OXT' HG22 ' B' ' 81' ' ' ILE . 3.0 mp . . . . . 0 N--CA 1.491 1.607 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.122 -179.878 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mtp . . . . . 0 N--CA 1.494 1.734 0 CA-C-O 121.207 0.527 . . . . 0.0 110.111 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.421 ' O ' HG23 ' A' ' 4' ' ' ILE . 23.9 p -125.11 109.85 27.15 Favored Pre-proline 0 N--CA 1.492 1.629 0 O-C-N 121.296 -0.877 . . . . 0.0 110.106 179.933 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . . . . . . . . . 44.4 Cg_endo -50.75 149.48 14.09 Favored 'Trans proline' 0 C--N 1.305 -1.733 0 O-C-N 124.003 1.528 . . . . 0.0 110.364 179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.865 HD11 ' HA3' ' A' ' 77' ' ' GLY . 1.0 OUTLIER -143.49 175.84 3.46 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.315 -0.866 . . . . 0.0 110.354 -179.786 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.734 HG13 HG11 ' A' ' 74' ' ' VAL . 78.4 t -145.68 121.11 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 O-C-N 121.173 -0.955 . . . . 0.0 110.168 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.575 ' CD2' ' OG1' ' A' ' 50' ' ' THR . 0.0 OUTLIER -105.39 125.72 51.31 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.243 -0.911 . . . . 0.0 110.333 179.975 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.579 ' O ' HG23 ' A' ' 48' ' ' ILE . 3.3 mp -117.65 141.38 48.45 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.275 -0.89 . . . . 0.0 110.072 179.87 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.524 ' HG3' ' N ' ' A' ' 9' ' ' GLY . 20.5 tptp -139.09 160.44 39.79 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.152 -0.968 . . . . 0.0 110.455 -179.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.524 ' N ' ' HG3' ' A' ' 8' ' ' LYS . . . 156.75 -156.76 27.43 Favored Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.65 -1.38 . . . . 0.0 109.65 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . 0.481 ' OD1' ' HB2' ' A' ' 12' ' ' ASN . 6.9 t70 -65.14 124.93 23.42 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.306 -1.114 . . . . 0.0 110.452 -179.878 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.929 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.16 -36.09 28.77 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.261 -0.9 . . . . 0.0 110.388 179.877 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.481 ' HB2' ' OD1' ' A' ' 10' ' ' ASP . 3.9 m-20 -69.2 -46.83 66.46 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.162 -0.961 . . . . 0.0 110.682 -179.665 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.534 ' CG2' HD11 ' A' ' 72' ' ' ILE . 54.9 m -57.69 -24.05 54.76 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.148 -0.97 . . . . 0.0 110.298 -179.8 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.968 ' HA ' HD12 ' A' ' 17' ' ' LEU . 51.9 mt -69.06 -32.36 71.76 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.281 -0.887 . . . . 0.0 110.415 -179.943 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 30.9 ttmt -59.59 -38.24 80.67 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.242 -0.911 . . . . 0.0 110.373 -179.827 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.416 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 5.8 t -70.08 -36.64 75.07 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.158 -0.964 . . . . 0.0 110.506 -179.867 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.968 HD12 ' HA ' ' A' ' 14' ' ' LEU . 31.6 mt -58.6 -50.9 72.13 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.239 -0.913 . . . . 0.0 110.308 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.576 ' HA ' ' CD2' ' A' ' 21' ' ' PHE . 11.0 ttm180 -46.4 -27.21 1.0 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.147 -0.971 . . . . 0.0 110.548 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.456 ' CD1' ' C ' ' A' ' 19' ' ' TYR . 9.5 t80 -64.93 -42.08 94.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.141 -0.974 . . . . 0.0 110.612 -179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.55 ' O ' ' CD2' ' A' ' 24' ' ' HIS . 74.1 mtt180 -72.13 -22.4 61.33 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.086 -1.009 . . . . 0.0 110.447 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.576 ' CD2' ' HA ' ' A' ' 18' ' ' ARG . 12.8 m-30 -66.58 -9.85 39.52 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.131 -0.981 . . . . 0.0 110.275 179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 8.7 mmtt -63.59 -50.92 67.53 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.257 -0.902 . . . . 0.0 110.536 -179.833 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 13.3 mmtp -75.14 -14.75 60.59 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.121 -0.987 . . . . 0.0 110.313 -179.805 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.593 ' CG ' HD12 ' A' ' 27' ' ' LEU . 7.1 m-70 -94.92 19.89 9.64 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.183 -0.948 . . . . 0.0 110.221 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.496 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 24.5 p -56.83 -24.76 53.39 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.249 -0.907 . . . . 0.0 110.052 179.959 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.463 HG22 ' H ' ' A' ' 26' ' ' THR . 3.5 t -97.08 3.48 51.75 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.219 -0.925 . . . . 0.0 110.161 179.9 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.593 HD12 ' CG ' ' A' ' 24' ' ' HIS . 23.9 mt -92.13 -32.49 15.11 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.207 -0.933 . . . . 0.0 110.507 -179.763 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.496 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 50.8 p90 -117.6 167.53 11.24 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.039 -1.038 . . . . 0.0 109.944 179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.8 m -100.26 -31.09 11.53 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.185 -0.947 . . . . 0.0 110.575 -179.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.93 117.03 2.56 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.104 -0.998 . . . . 0.0 110.792 -179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.498 ' O ' HG13 ' A' ' 31' ' ' VAL . 3.0 p -89.04 114.71 27.62 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.211 -0.931 . . . . 0.0 110.146 179.941 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.597 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 88.5 p -68.18 143.31 55.4 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.258 -0.901 . . . . 0.0 110.325 -179.916 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.461 ' HB3' ' O ' ' B' ' 36' ' ' HIS . 2.2 p -61.41 162.06 8.47 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.284 -0.885 . . . . 0.0 110.128 179.822 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.851 ' CG2' ' HB1' ' A' ' 47' ' ' ALA . 91.3 m -67.96 134.57 50.99 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.224 -0.922 . . . . 0.0 110.098 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.534 ' O ' ' N ' ' A' ' 48' ' ' ILE . 41.9 p-90 -146.52 -179.21 6.61 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.141 -0.975 . . . . 0.0 109.921 179.922 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.607 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 46.1 t60 -162.52 174.32 12.82 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.112 -0.992 . . . . 0.0 110.417 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.607 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 89.0 m95 -78.43 105.39 9.66 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.309 -0.87 . . . . 0.0 110.185 -179.652 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.734 HG23 HG13 ' A' ' 42' ' ' VAL . 46.3 m -138.54 150.86 46.79 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.41 -0.806 . . . . 0.0 110.109 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.43 ' O ' HG12 ' A' ' 42' ' ' VAL . . . -163.78 163.46 35.81 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 19.1 m170 54.94 -153.45 0.32 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.276 -1.132 . . . . 0.0 110.234 -179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 -80.83 108.61 14.64 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.253 -0.905 . . . . 0.0 110.243 -179.879 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.734 HG13 HG23 ' A' ' 38' ' ' THR . 5.0 p -177.02 153.69 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 121.264 -0.898 . . . . 0.0 109.88 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.9 mtpt -103.91 159.62 15.5 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.083 -1.01 . . . . 0.0 110.65 -179.642 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.831 ' NE2' ' HB2' ' A' ' 47' ' ' ALA . 4.8 t-80 -50.26 164.69 0.11 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.39 -0.819 . . . . 0.0 110.275 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.491 ' N ' ' CG ' ' A' ' 44' ' ' HIS . 0.3 OUTLIER -155.38 -79.17 0.09 Allowed 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.177 -0.952 . . . . 0.0 110.547 179.899 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.493 ' HB2' ' ND1' ' A' ' 36' ' ' HIS . 0.9 OUTLIER -83.78 70.09 10.31 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.206 -0.934 . . . . 0.0 110.454 -179.632 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.851 ' HB1' ' CG2' ' A' ' 34' ' ' THR . . . -46.24 143.01 2.59 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.335 -0.853 . . . . 0.0 110.509 -179.685 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.579 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.5 mt -142.93 134.3 23.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.677 0 O-C-N 121.364 -0.835 . . . . 0.0 109.93 179.873 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.402 HG12 ' N ' ' A' ' 50' ' ' THR . 62.0 t -106.92 161.2 6.0 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.195 -0.94 . . . . 0.0 110.487 -179.795 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.575 ' OG1' ' CD2' ' A' ' 6' ' ' HIS . 22.4 m -145.82 160.15 42.19 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.296 -0.877 . . . . 0.0 109.885 179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.2 134.85 38.59 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.178 -0.951 . . . . 0.0 110.266 -179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.24 128.35 43.08 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.279 -0.888 . . . . 0.0 110.423 -179.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.445 ' OH ' ' CD2' ' A' ' 62' ' ' PHE . 61.5 m-85 -118.42 151.01 38.59 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.308 -0.87 . . . . 0.0 110.228 179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -103.72 -16.67 15.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.217 -0.927 . . . . 0.0 110.341 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 20.3 m -128.61 131.53 48.13 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.172 -0.955 . . . . 0.0 110.125 -179.986 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -57.44 -50.04 74.31 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.237 -0.915 . . . . 0.0 110.347 -179.849 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.65 -43.71 69.02 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.187 -0.945 . . . . 0.0 110.429 -179.811 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -57.79 -44.91 86.61 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.313 -0.867 . . . . 0.0 110.589 -179.302 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.429 ' HD2' HG23 ' A' ' 5' ' ' VAL . 4.9 ttt-85 -58.79 -40.45 84.06 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.041 -1.037 . . . . 0.0 110.039 179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 85.5 m-20 -61.42 -36.18 79.62 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.213 -0.929 . . . . 0.0 110.424 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.478 ' O ' ' HG3' ' A' ' 65' ' ' GLN . 61.9 mt-30 -65.64 -44.85 85.16 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.146 -0.971 . . . . 0.0 110.297 -179.802 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.64 ' O ' HG22 ' A' ' 66' ' ' VAL . 4.2 t80 -55.75 -46.16 77.9 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.279 -0.888 . . . . 0.0 110.598 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 75.2 mt -59.44 -23.0 62.31 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.216 -0.927 . . . . 0.0 110.747 -179.502 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 59.9 p -93.01 -19.87 21.15 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.074 -1.017 . . . . 0.0 110.619 -179.716 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.478 ' HG3' ' O ' ' A' ' 61' ' ' GLN . 27.9 mt-30 -95.83 -8.6 33.77 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.154 -0.966 . . . . 0.0 110.173 -179.635 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.738 ' O ' HG23 ' A' ' 66' ' ' VAL . 16.9 m -111.82 108.57 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.531 0 O-C-N 121.278 -0.889 . . . . 0.0 110.047 179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -65.61 107.79 1.84 Allowed 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.236 -0.915 . . . . 0.0 110.243 -179.864 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.404 ' HA ' HD13 ' A' ' 68' ' ' ILE . 16.2 mm -88.96 128.36 52.33 Favored Pre-proline 0 N--CA 1.491 1.603 0 O-C-N 121.225 -0.922 . . . . 0.0 110.218 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 1.078 ' CG ' HD12 ' A' ' 72' ' ' ILE . 43.4 Cg_endo -58.83 -155.89 0.01 OUTLIER 'Trans proline' 0 C--N 1.305 -1.715 0 O-C-N 123.948 1.499 . . . . 0.0 110.366 179.912 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.521 ' O ' ' HD3' ' A' ' 70' ' ' LYS . 0.0 OUTLIER -111.02 40.76 1.96 Allowed 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.144 -0.972 . . . . 0.0 110.554 -179.729 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.74 -15.64 0.12 Allowed 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.266 -0.896 . . . . 0.0 111.663 -179.824 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 1.078 HD12 ' CG ' ' A' ' 69' ' ' PRO . 19.1 mt -94.95 103.44 14.7 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 120.693 -1.255 . . . . 0.0 110.037 179.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . 0.429 HG22 ' N ' ' A' ' 74' ' ' VAL . 61.6 m -95.85 163.9 12.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.289 -0.882 . . . . 0.0 109.969 179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.734 HG11 HG13 ' A' ' 5' ' ' VAL . 21.3 t -143.11 130.09 17.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.641 0 O-C-N 121.056 -1.028 . . . . 0.0 111.651 -178.558 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -101.87 177.43 4.9 Favored 'General case' 0 N--CA 1.492 1.672 0 CA-C-O 121.293 0.568 . . . . 0.0 110.089 179.421 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.406 ' O ' ' O ' ' B' ' 80' ' ' SER . 0.7 OUTLIER -111.84 152.97 27.3 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.176 -0.952 . . . . 0.0 110.252 179.909 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.865 ' HA3' HD11 ' A' ' 4' ' ' ILE . . . -158.87 168.7 35.04 Favored Glycine 0 N--CA 1.49 2.276 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 179.919 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' B' ' 78' ' ' PHE . 70.9 m-85 -147.71 124.82 11.42 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.142 -1.211 . . . . 0.0 110.174 179.939 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -98.3 174.24 6.59 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.223 -0.923 . . . . 0.0 110.384 -179.866 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.543 ' C ' HG23 ' A' ' 81' ' ' ILE . 0.0 OUTLIER -144.21 106.34 4.36 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.28 -0.888 . . . . 0.0 110.105 179.976 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.543 HG23 ' C ' ' A' ' 80' ' ' SER . 10.7 pt . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 117.94 -1.029 . . . . 0.0 110.266 -179.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.185 0.517 . . . . 0.0 110.1 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.436 ' O ' HG23 ' B' ' 4' ' ' ILE . 24.4 p -125.74 108.59 25.65 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.178 -0.951 . . . . 0.0 110.323 -179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_endo -49.3 150.04 8.33 Favored 'Trans proline' 0 C--N 1.306 -1.704 0 O-C-N 124.06 1.558 . . . . 0.0 110.533 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.876 HD11 ' HA3' ' B' ' 77' ' ' GLY . 1.0 OUTLIER -143.88 176.23 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.327 -0.858 . . . . 0.0 110.391 -179.87 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.722 HG13 HG11 ' B' ' 74' ' ' VAL . 77.6 t -145.89 120.91 3.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.623 0 O-C-N 121.245 -0.909 . . . . 0.0 110.1 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.574 ' CD2' ' OG1' ' B' ' 50' ' ' THR . 0.0 OUTLIER -105.59 125.54 51.1 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.298 -0.876 . . . . 0.0 110.307 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.597 ' O ' HG23 ' B' ' 48' ' ' ILE . 3.1 mp -117.34 141.43 48.33 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.327 -0.858 . . . . 0.0 110.194 179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.519 ' HG3' ' N ' ' B' ' 9' ' ' GLY . 20.8 tptp -139.13 160.02 40.77 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.139 -0.976 . . . . 0.0 110.45 -179.091 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.519 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 156.88 -156.6 27.31 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.569 -1.412 . . . . 0.0 109.569 -179.849 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . 0.453 ' OD1' ' HB2' ' B' ' 12' ' ' ASN . 5.4 t70 -65.15 125.01 23.66 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.29 -1.124 . . . . 0.0 110.423 -179.911 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.956 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.14 -36.8 31.5 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.308 -0.87 . . . . 0.0 110.47 179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . 0.453 ' HB2' ' OD1' ' B' ' 10' ' ' ASP . 3.7 m-20 -68.35 -47.32 67.78 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.185 -0.947 . . . . 0.0 110.702 -179.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.537 ' CG2' HD11 ' B' ' 72' ' ' ILE . 63.1 m -57.79 -23.04 50.51 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.151 -0.968 . . . . 0.0 110.247 -179.695 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.956 HD12 ' HA ' ' B' ' 11' ' ' ALA . 53.9 mt -69.65 -32.11 70.59 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.289 -0.882 . . . . 0.0 110.285 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 31.5 ttmt -59.72 -38.75 82.5 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.249 -0.907 . . . . 0.0 110.419 -179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.434 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 6.8 t -70.04 -36.64 75.18 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.927 . . . . 0.0 110.459 -179.623 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.952 HD12 ' HA ' ' B' ' 14' ' ' LEU . 30.2 mt -58.59 -50.7 72.86 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.134 -0.978 . . . . 0.0 110.3 -179.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.568 ' HA ' ' CD2' ' B' ' 21' ' ' PHE . 10.9 ttm180 -46.5 -27.13 1.01 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.31 -0.869 . . . . 0.0 110.401 179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.463 ' CD1' ' C ' ' B' ' 19' ' ' TYR . 9.1 t80 -64.99 -42.35 94.59 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.188 -0.945 . . . . 0.0 110.694 -179.689 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . 0.549 ' O ' ' CD2' ' B' ' 24' ' ' HIS . 74.8 mtt180 -71.58 -22.63 61.71 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.165 -0.959 . . . . 0.0 110.402 -179.742 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.568 ' CD2' ' HA ' ' B' ' 18' ' ' ARG . 12.7 m-30 -66.44 -9.9 38.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.142 -0.974 . . . . 0.0 110.341 -179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 8.6 mmtt -63.67 -50.87 67.54 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.237 -0.914 . . . . 0.0 110.434 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 13.4 mmtp -75.07 -14.66 60.61 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.201 -0.937 . . . . 0.0 110.235 -179.853 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.585 ' CG ' HD12 ' B' ' 27' ' ' LEU . 7.8 m-70 -94.92 19.75 9.82 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.144 -0.973 . . . . 0.0 110.186 -179.992 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.493 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 25.4 p -57.08 -25.07 58.12 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.252 -0.905 . . . . 0.0 110.173 179.901 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.452 HG22 ' H ' ' B' ' 26' ' ' THR . 3.4 t -96.84 3.37 52.25 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.265 -0.897 . . . . 0.0 110.001 179.923 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.585 HD12 ' CG ' ' B' ' 24' ' ' HIS . 23.9 mt -92.03 -32.61 15.13 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.288 -0.883 . . . . 0.0 110.501 -179.774 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.493 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 50.6 p90 -117.64 167.17 11.58 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.004 -1.06 . . . . 0.0 110.129 -179.995 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 1.9 m -100.07 -31.06 11.61 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.149 -0.969 . . . . 0.0 110.665 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.92 116.88 2.55 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.006 -1.059 . . . . 0.0 110.744 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.519 ' O ' HG13 ' B' ' 31' ' ' VAL . 3.1 p -89.1 112.88 24.82 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.678 0 O-C-N 121.182 -0.949 . . . . 0.0 110.073 179.872 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.532 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 91.1 p -66.43 142.95 57.4 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.218 -0.926 . . . . 0.0 110.367 -179.908 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 1.5 p -61.32 162.11 8.19 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.215 -0.928 . . . . 0.0 110.086 179.887 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.809 ' CG2' ' HB1' ' B' ' 47' ' ' ALA . 89.6 m -68.0 134.81 51.33 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.22 -0.925 . . . . 0.0 110.207 -179.884 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.597 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 41.1 p-90 -146.36 -179.15 6.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.193 -0.942 . . . . 0.0 109.913 179.893 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.614 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 46.0 t60 -162.53 174.41 12.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.128 -0.982 . . . . 0.0 110.427 -179.671 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.614 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 88.1 m95 -78.65 104.94 9.6 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.336 -0.853 . . . . 0.0 110.294 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.748 HG23 HG13 ' B' ' 42' ' ' VAL . 44.5 m -138.21 152.01 48.22 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.431 -0.793 . . . . 0.0 109.943 -179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . 0.425 ' O ' ' CG1' ' B' ' 42' ' ' VAL . . . -164.91 163.08 36.17 Favored Glycine 0 N--CA 1.491 2.313 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 -179.79 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 19.6 m170 55.22 -153.35 0.33 Allowed 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.299 -1.118 . . . . 0.0 110.197 179.928 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . 0.402 ' O ' ' HB ' ' B' ' 42' ' ' VAL . 6.2 t-20 -80.79 108.44 14.45 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.188 -0.945 . . . . 0.0 110.189 -179.838 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.748 HG13 HG23 ' B' ' 38' ' ' THR . 5.5 p -176.95 153.86 0.26 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.617 0 O-C-N 121.248 -0.908 . . . . 0.0 109.958 -179.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 18.6 mtpt -104.12 159.21 15.87 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.206 -0.934 . . . . 0.0 110.652 -179.647 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . 0.833 ' NE2' ' HB2' ' B' ' 47' ' ' ALA . 5.0 t-80 -50.29 165.06 0.1 Allowed 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.43 -0.794 . . . . 0.0 110.291 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . 0.487 ' N ' ' CG ' ' B' ' 44' ' ' HIS . 0.8 OUTLIER -155.78 -78.37 0.09 Allowed 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.321 -0.862 . . . . 0.0 110.547 -179.97 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.5 ' HB2' ' ND1' ' B' ' 36' ' ' HIS . 0.9 OUTLIER -84.31 70.26 10.59 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.26 -0.9 . . . . 0.0 110.456 -179.69 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.833 ' HB2' ' NE2' ' B' ' 44' ' ' HIS . . . -46.4 142.2 3.15 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.387 -0.821 . . . . 0.0 110.645 -179.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.597 HG23 ' O ' ' B' ' 7' ' ' LEU . 45.4 mt -142.59 134.85 25.99 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.633 0 O-C-N 121.289 -0.882 . . . . 0.0 110.025 179.847 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 61.8 t -107.64 161.22 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 O-C-N 121.157 -0.964 . . . . 0.0 110.522 -179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.574 ' OG1' ' CD2' ' B' ' 6' ' ' HIS . 23.6 m -145.88 160.32 41.98 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.411 -0.805 . . . . 0.0 109.908 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -136.36 134.96 38.41 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.162 -0.962 . . . . 0.0 110.335 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -96.39 127.29 42.25 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.235 -0.915 . . . . 0.0 110.255 -179.855 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.459 ' OH ' ' CD2' ' B' ' 62' ' ' PHE . 61.0 m-85 -117.11 150.81 38.06 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.349 -0.844 . . . . 0.0 109.982 179.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.8 t0 -103.49 -16.72 15.48 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.262 -0.899 . . . . 0.0 110.197 -179.894 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 19.4 m -128.43 132.42 48.45 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.151 -0.968 . . . . 0.0 110.181 -179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -58.19 -49.89 75.47 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.285 -0.885 . . . . 0.0 110.252 -179.925 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 1.5 t90 -53.76 -43.52 69.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.342 -0.849 . . . . 0.0 110.527 -179.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 35.9 tt0 -57.85 -45.29 86.49 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.319 -0.863 . . . . 0.0 110.612 -179.351 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.463 ' HD2' HG23 ' B' ' 5' ' ' VAL . 4.7 ttt-85 -58.83 -40.86 85.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.091 -1.005 . . . . 0.0 110.119 179.987 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 85.0 m-20 -61.12 -35.79 77.99 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.32 -0.862 . . . . 0.0 110.301 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.464 ' O ' ' HG3' ' B' ' 65' ' ' GLN . 60.3 mt-30 -65.61 -45.21 84.0 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.243 -0.91 . . . . 0.0 110.391 -179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.66 ' O ' HG22 ' B' ' 66' ' ' VAL . 4.4 t80 -55.53 -46.2 77.1 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.314 -0.866 . . . . 0.0 110.703 -179.732 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.57 -22.03 61.16 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.233 -0.917 . . . . 0.0 110.693 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 58.9 p -93.92 -19.82 20.59 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.247 -0.908 . . . . 0.0 110.574 -179.669 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . 0.464 ' HG3' ' O ' ' B' ' 61' ' ' GLN . 30.0 mt-30 -95.82 -9.58 31.2 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.21 -0.931 . . . . 0.0 110.066 -179.771 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.73 HG23 ' O ' ' B' ' 66' ' ' VAL . 16.8 m -110.75 109.02 26.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.516 0 O-C-N 121.317 -0.865 . . . . 0.0 110.155 179.913 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 11.9 tptp -66.31 107.96 2.17 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.347 -0.846 . . . . 0.0 110.266 -179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.437 ' O ' ' O ' ' B' ' 69' ' ' PRO . 17.1 mm -89.1 127.45 55.45 Favored Pre-proline 0 N--CA 1.491 1.595 0 O-C-N 121.297 -0.877 . . . . 0.0 110.41 -179.956 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 1.081 ' CG ' HD12 ' B' ' 72' ' ' ILE . 43.5 Cg_endo -57.46 -155.48 0.01 OUTLIER 'Trans proline' 0 C--N 1.304 -1.771 0 O-C-N 124.054 1.555 . . . . 0.0 110.442 179.675 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . 0.521 ' HD3' ' O ' ' B' ' 70' ' ' LYS . 0.0 OUTLIER -112.15 40.84 2.1 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.025 -1.047 . . . . 0.0 110.458 -179.775 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -154.63 -15.7 0.12 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.295 -0.878 . . . . 0.0 111.616 -179.897 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 1.081 HD12 ' CG ' ' B' ' 69' ' ' PRO . 20.7 mt -94.98 102.95 14.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.565 0 O-C-N 120.934 -1.104 . . . . 0.0 109.898 179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . 0.425 HG22 ' N ' ' B' ' 74' ' ' VAL . 66.0 m -95.45 163.71 13.12 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.286 -0.883 . . . . 0.0 110.083 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.722 HG11 HG13 ' B' ' 5' ' ' VAL . 21.5 t -142.88 130.64 19.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.605 0 O-C-N 121.05 -1.031 . . . . 0.0 111.615 -178.593 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . 0.429 ' HB3' HG22 ' A' ' 81' ' ' ILE . 0.1 OUTLIER -101.97 178.7 4.54 Favored 'General case' 0 N--CA 1.491 1.597 0 CA-C-N 116.104 -0.498 . . . . 0.0 110.144 179.62 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . 0.486 ' O ' ' O ' ' A' ' 80' ' ' SER . 0.7 OUTLIER -113.75 151.07 32.45 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 179.81 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.876 ' HA3' HD11 ' B' ' 4' ' ' ILE . . . -157.23 169.7 34.32 Favored Glycine 0 N--CA 1.492 2.392 0 N-CA-C 109.572 -1.411 . . . . 0.0 109.572 179.999 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.466 ' O ' ' O ' ' A' ' 78' ' ' PHE . 69.4 m-85 -147.85 126.57 12.59 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.24 -1.153 . . . . 0.0 110.136 -179.924 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.541 ' CE ' ' CE1' ' A' ' 6' ' ' HIS . 0.0 OUTLIER -100.57 172.59 7.01 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.093 -1.005 . . . . 0.0 110.297 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.54 ' C ' HG23 ' B' ' 81' ' ' ILE . 0.1 OUTLIER -142.48 107.06 4.82 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.264 -0.897 . . . . 0.0 109.875 179.86 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.54 HG23 ' C ' ' B' ' 80' ' ' SER . 10.5 pt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 118.028 -0.987 . . . . 0.0 110.284 -179.865 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.5 ' HB2' ' CE2' ' A' ' 78' ' ' PHE . 23.9 mtp . . . . . 0 N--CA 1.492 1.631 0 CA-C-O 121.303 0.573 . . . . 0.0 110.108 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . 0.486 HG23 ' O ' ' A' ' 53' ' ' TYR . 52.1 m -128.04 133.17 24.84 Favored Pre-proline 0 N--CA 1.492 1.645 0 O-C-N 121.294 -0.879 . . . . 0.0 109.913 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.517 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 49.9 Cg_endo -81.5 161.7 19.51 Favored 'Trans proline' 0 C--N 1.305 -1.724 0 O-C-N 123.925 1.487 . . . . 0.0 110.319 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.609 HG22 ' CG2' ' A' ' 52' ' ' THR . 6.5 pt -144.05 163.63 14.79 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.279 -0.888 . . . . 0.0 110.093 179.836 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 42.8 t -145.75 129.84 11.35 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.664 0 O-C-N 121.194 -0.941 . . . . 0.0 110.129 -179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 75' ' ' SER . 0.2 OUTLIER -105.37 137.0 43.88 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.267 -0.895 . . . . 0.0 110.374 -179.881 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.671 HD21 ' HB ' ' A' ' 49' ' ' VAL . 3.4 pp -125.38 142.78 51.31 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.343 -0.848 . . . . 0.0 109.826 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.831 ' O ' HD13 ' A' ' 72' ' ' ILE . 21.6 tptt -136.18 154.82 50.84 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.054 -1.028 . . . . 0.0 110.833 -178.877 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 161.89 -178.74 37.63 Favored Glycine 0 N--CA 1.486 1.985 0 N-CA-C 108.455 -1.858 . . . . 0.0 108.455 -179.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.8 t0 -66.56 150.47 48.95 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.976 -1.308 . . . . 0.0 111.07 -179.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.849 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -50.83 -52.18 43.89 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.268 -0.895 . . . . 0.0 110.143 179.299 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 88.4 m-20 -48.82 -45.55 40.62 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.11 -0.994 . . . . 0.0 110.16 -179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 76.2 m -58.03 -20.89 42.38 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.33 -0.856 . . . . 0.0 110.203 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.849 HD12 ' HA ' ' A' ' 11' ' ' ALA . 16.5 mt -83.93 -32.32 25.15 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.235 -0.915 . . . . 0.0 110.302 -179.918 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 4.7 ttmt -60.91 -37.04 80.85 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.075 -1.016 . . . . 0.0 110.488 179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -70.4 -47.77 59.27 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.268 -0.895 . . . . 0.0 111.384 -179.054 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 63.0 mt -58.44 -52.38 65.89 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.072 -1.017 . . . . 0.0 110.539 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 24.9 ttp180 -45.66 -33.94 3.2 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.206 -0.934 . . . . 0.0 110.173 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 65.4 t80 -64.73 -13.13 53.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.233 -0.917 . . . . 0.0 110.163 179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -100.22 -33.2 10.53 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.244 -0.91 . . . . 0.0 110.241 179.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.561 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 8.7 m-30 -66.59 -33.63 76.1 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.253 -0.905 . . . . 0.0 110.289 -179.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.48 -44.83 93.26 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.209 -0.932 . . . . 0.0 110.383 -179.757 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.3 mmtm -75.03 -32.63 61.62 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.187 -0.946 . . . . 0.0 110.249 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.606 ' O ' ' N ' ' A' ' 26' ' ' THR . 28.6 m170 -95.78 34.65 1.48 Allowed 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.322 -0.861 . . . . 0.0 110.34 -179.859 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.601 ' HA ' ' CE2' ' A' ' 28' ' ' TYR . 13.2 p -59.6 43.53 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.435 -0.791 . . . . 0.0 112.011 179.985 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.606 ' N ' ' O ' ' A' ' 24' ' ' HIS . 75.3 p -144.72 33.29 1.14 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 120.768 -1.208 . . . . 0.0 109.663 179.561 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.405 ' HG ' ' C ' ' A' ' 26' ' ' THR . 78.6 mt -146.31 -5.79 0.57 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.183 -0.948 . . . . 0.0 111.448 -179.331 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.601 ' CE2' ' HA ' ' A' ' 25' ' ' CYS . 10.5 p90 -126.13 162.38 25.5 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.686 -1.259 . . . . 0.0 108.912 178.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.495 ' HB ' ' O ' ' A' ' 52' ' ' THR . 6.6 m -101.81 -38.74 7.71 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 120.641 -1.287 . . . . 0.0 111.34 -179.434 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.01 120.08 2.93 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 120.881 -1.137 . . . . 0.0 111.109 -179.758 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.652 ' O ' HG22 ' B' ' 38' ' ' THR . 3.2 p -88.97 105.65 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.281 -0.887 . . . . 0.0 109.893 179.41 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.608 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 54.7 p -64.35 152.87 40.14 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.336 -0.853 . . . . 0.0 110.528 -179.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.46 155.56 21.49 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.278 -0.888 . . . . 0.0 110.109 179.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . 0.58 ' HA ' HG22 ' A' ' 49' ' ' VAL . 31.9 m -68.05 129.18 39.12 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.223 -0.923 . . . . 0.0 110.546 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.604 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 50.5 p-90 -147.13 179.92 7.28 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.207 -0.933 . . . . 0.0 110.125 179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.595 ' CG ' ' HA ' ' A' ' 46' ' ' SER . 36.2 t-80 -162.57 173.27 14.19 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.227 -0.921 . . . . 0.0 109.977 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.539 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 98.1 m95 -79.07 126.0 30.14 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.13 -0.981 . . . . 0.0 109.928 -179.895 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.416 HG22 ' O ' ' B' ' 31' ' ' VAL . 11.4 t -107.85 152.8 23.91 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.279 -0.888 . . . . 0.0 110.178 -179.766 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -170.24 175.88 44.07 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.44 -1.464 . . . . 0.0 109.44 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 52.6 m80 -63.02 -27.78 69.65 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.273 -1.134 . . . . 0.0 110.237 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -125.44 101.72 7.07 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.249 -0.907 . . . . 0.0 110.124 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 19.0 m -115.18 176.67 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.292 -0.88 . . . . 0.0 110.151 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 5.0 pttt -131.97 -175.33 3.7 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.282 -0.886 . . . . 0.0 110.145 179.868 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 11.8 t-160 -51.9 -54.97 23.22 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.324 -0.86 . . . . 0.0 110.255 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . 0.481 ' HE2' ' HE2' ' A' ' 8' ' ' LYS . 13.5 mtpt -52.52 114.51 1.4 Allowed 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.261 -0.899 . . . . 0.0 110.321 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.595 ' HA ' ' CG ' ' A' ' 36' ' ' HIS . 1.8 t -160.98 66.23 0.3 Allowed 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.192 -0.943 . . . . 0.0 110.288 179.978 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -169.36 115.23 0.57 Allowed 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.276 -0.89 . . . . 0.0 110.189 179.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.628 HG23 ' O ' ' A' ' 7' ' ' LEU . 68.7 mt -142.8 155.99 17.88 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.406 -0.809 . . . . 0.0 109.854 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.671 ' HB ' HD21 ' A' ' 7' ' ' LEU . 87.2 t -136.24 129.79 47.1 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.144 -0.972 . . . . 0.0 110.524 -179.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.469 ' OG1' ' NE2' ' A' ' 6' ' ' HIS . 86.5 m -93.94 150.06 20.69 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.352 -0.843 . . . . 0.0 110.071 179.75 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.55 HD12 HD23 ' A' ' 7' ' ' LEU . 0.5 OUTLIER -135.05 121.18 20.03 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.103 -0.998 . . . . 0.0 110.055 179.993 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.609 ' CG2' HG22 ' A' ' 4' ' ' ILE . 0.0 OUTLIER -99.0 144.26 28.36 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.343 -0.848 . . . . 0.0 110.408 179.912 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.517 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 26.4 m-85 -124.08 156.73 36.07 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.166 -0.959 . . . . 0.0 109.839 179.56 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 50.7 m-20 -83.67 -6.03 59.34 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.149 -0.97 . . . . 0.0 110.682 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.1 m -163.98 156.4 17.35 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.092 -1.005 . . . . 0.0 110.408 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' A' ' 59' ' ' ARG . 62.9 mt-10 -68.62 -41.25 79.73 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.258 -0.901 . . . . 0.0 110.28 -179.969 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.412 ' O ' ' HG3' ' A' ' 61' ' ' GLN . 6.0 t90 -53.64 -52.75 58.89 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.179 -0.95 . . . . 0.0 109.982 -179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.46 ' O ' ' HB2' ' A' ' 61' ' ' GLN . 48.1 tt0 -58.98 -32.86 70.04 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.384 -0.823 . . . . 0.0 110.253 179.795 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' A' ' 56' ' ' GLU . 3.6 ttm180 -59.02 -54.52 46.19 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.302 -0.874 . . . . 0.0 110.621 -179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -61.04 -25.87 67.23 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.193 -0.942 . . . . 0.0 110.32 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.46 ' HB2' ' O ' ' A' ' 58' ' ' GLN . 68.4 mt-30 -65.63 -54.36 28.81 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.159 -0.963 . . . . 0.0 110.308 179.957 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.9 ' CE2' HG21 ' A' ' 66' ' ' VAL . 7.2 t80 -55.76 -46.75 77.81 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.343 -0.848 . . . . 0.0 110.456 -179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.4 mt -59.14 -20.64 55.45 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.281 -0.887 . . . . 0.0 110.343 -179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.44 -22.54 19.56 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.253 -0.904 . . . . 0.0 110.289 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 8.7 mm-40 -96.41 -21.56 17.69 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.236 -0.915 . . . . 0.0 110.2 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.9 HG21 ' CE2' ' A' ' 62' ' ' PHE . 59.9 t -97.55 105.55 17.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.294 -0.879 . . . . 0.0 110.47 -179.621 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . 0.422 ' CG ' ' O ' ' A' ' 67' ' ' LYS . 0.7 OUTLIER -58.26 103.23 0.14 Allowed 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.238 -0.914 . . . . 0.0 109.899 179.664 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.581 HG23 ' CG2' ' A' ' 72' ' ' ILE . 40.6 mt -88.9 99.51 1.57 Allowed Pre-proline 0 N--CA 1.49 1.57 0 O-C-N 121.188 -0.945 . . . . 0.0 110.094 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HG2' HG12 ' A' ' 72' ' ' ILE . 46.8 Cg_endo -45.13 159.41 0.15 Allowed 'Trans proline' 0 C--N 1.304 -1.788 0 O-C-N 124.069 1.563 . . . . 0.0 110.36 179.947 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 20.2 mtmt -63.82 -13.68 46.53 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.239 -0.913 . . . . 0.0 110.336 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 23.5 p -84.62 -21.11 30.45 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.268 -0.895 . . . . 0.0 110.195 -179.896 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.831 HD13 ' O ' ' A' ' 8' ' ' LYS . 6.8 mm -94.24 113.47 28.92 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 O-C-N 121.282 -0.886 . . . . 0.0 110.183 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 22.5 m -94.35 145.06 25.02 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.252 -0.905 . . . . 0.0 110.174 -179.852 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 1.6 p -90.51 171.8 1.06 Allowed 'Isoleucine or valine' 0 N--CA 1.492 1.649 0 O-C-N 121.204 -0.935 . . . . 0.0 110.921 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.596 ' CB ' ' HB2' ' A' ' 6' ' ' HIS . 0.6 OUTLIER -142.68 154.65 44.52 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.576 -0.703 . . . . 0.0 110.496 179.89 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 60.4 p -131.77 134.89 46.33 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.171 -0.956 . . . . 0.0 110.174 179.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.34 -170.7 34.2 Favored Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.834 -1.306 . . . . 0.0 109.834 -179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' B' ' 78' ' ' PHE . 0.0 OUTLIER -147.71 143.91 27.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.362 -1.081 . . . . 0.0 110.033 -179.934 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.2 mmm -135.89 155.42 50.32 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.779 -1.201 . . . . 0.0 110.649 -179.926 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -141.81 108.56 5.38 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.304 -0.873 . . . . 0.0 110.065 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 45.3 mt . . . . . 0 N--CA 1.491 1.624 0 CA-C-O 117.967 -1.016 . . . . 0.0 110.216 -179.972 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.514 ' HB2' ' CE2' ' B' ' 78' ' ' PHE . 22.5 mtp . . . . . 0 N--CA 1.492 1.663 0 CA-C-O 121.205 0.526 . . . . 0.0 110.274 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.514 HG23 ' O ' ' B' ' 53' ' ' TYR . 58.8 m -127.31 133.84 25.51 Favored Pre-proline 0 N--CA 1.492 1.635 0 O-C-N 121.382 -0.824 . . . . 0.0 110.154 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.51 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 48.0 Cg_endo -82.19 161.2 17.82 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 123.918 1.483 . . . . 0.0 110.287 -179.829 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.617 HG22 ' CG2' ' B' ' 52' ' ' THR . 6.4 pt -143.99 163.36 15.04 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.659 0 O-C-N 121.242 -0.911 . . . . 0.0 110.096 -179.923 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . . . . . . . . . 48.1 t -145.78 130.89 12.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.237 -0.915 . . . . 0.0 110.267 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.588 ' HB2' ' CB ' ' B' ' 75' ' ' SER . 0.2 OUTLIER -106.1 138.91 41.45 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.244 -0.91 . . . . 0.0 110.349 -179.943 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.654 HD21 ' HB ' ' B' ' 49' ' ' VAL . 3.5 pp -127.96 142.9 51.12 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.195 -0.941 . . . . 0.0 110.299 -179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.859 ' O ' HD13 ' B' ' 72' ' ' ILE . 24.1 tptt -140.21 163.17 33.47 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.118 -0.989 . . . . 0.0 110.526 -179.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.509 ' N ' ' HG3' ' B' ' 8' ' ' LYS . . . 166.16 -79.7 0.12 Allowed Glycine 0 N--CA 1.494 2.562 0 N-CA-C 110.274 -1.13 . . . . 0.0 110.274 179.825 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 13.1 t70 -173.28 150.7 1.92 Allowed 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.252 -1.146 . . . . 0.0 109.509 -179.611 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.653 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -49.39 -57.3 7.17 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.281 -0.887 . . . . 0.0 110.645 -179.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 88.0 m-20 -50.65 -48.51 58.2 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.203 -0.935 . . . . 0.0 110.408 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . . . . . . . . . 69.8 m -58.19 -21.99 49.88 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.171 -0.956 . . . . 0.0 110.484 -179.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.653 HD12 ' HA ' ' B' ' 11' ' ' ALA . 16.3 mt -83.34 -32.83 26.05 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.137 -0.977 . . . . 0.0 110.603 -179.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 4.8 ttmt -60.81 -36.98 80.42 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.016 -1.053 . . . . 0.0 110.635 -179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -69.99 -47.5 61.98 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.232 -0.917 . . . . 0.0 111.181 -179.191 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 69.3 mt -58.54 -52.7 64.53 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.104 -0.998 . . . . 0.0 110.664 -179.343 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 25.5 ttp180 -45.28 -33.69 2.53 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.232 -0.917 . . . . 0.0 110.135 -179.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -64.82 -13.64 56.55 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.269 -0.895 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -99.48 -33.4 10.68 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.169 -0.957 . . . . 0.0 110.172 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.576 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 8.1 m-30 -66.49 -33.91 76.74 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.23 -0.919 . . . . 0.0 110.355 -179.861 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -63.42 -44.7 93.87 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.23 -0.919 . . . . 0.0 110.343 -179.742 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 mmtm -74.97 -32.93 61.81 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.184 -0.947 . . . . 0.0 110.26 -179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.602 ' O ' ' N ' ' B' ' 26' ' ' THR . 28.8 m170 -95.48 35.09 1.37 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.281 -0.887 . . . . 0.0 110.238 -179.865 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.604 ' HA ' ' CE2' ' B' ' 28' ' ' TYR . 22.3 p -59.78 43.07 0.01 OUTLIER 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.467 -0.771 . . . . 0.0 112.139 -179.809 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.602 ' N ' ' O ' ' B' ' 24' ' ' HIS . 77.8 p -144.69 33.84 1.15 Allowed 'General case' 0 N--CA 1.489 1.518 0 O-C-N 120.729 -1.232 . . . . 0.0 109.846 179.512 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.423 ' HG ' ' C ' ' B' ' 26' ' ' THR . 81.5 mt -146.5 -6.04 0.55 Allowed 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.237 -0.914 . . . . 0.0 111.375 -179.401 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.604 ' CE2' ' HA ' ' B' ' 25' ' ' CYS . 10.9 p90 -125.42 162.61 24.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.701 -1.249 . . . . 0.0 108.779 178.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.501 ' HB ' ' O ' ' B' ' 52' ' ' THR . 6.9 m -101.77 -39.01 7.61 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.642 -1.286 . . . . 0.0 111.187 -179.554 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.97 120.18 2.97 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.059 -1.025 . . . . 0.0 111.185 -179.523 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.565 ' O ' HG13 ' B' ' 31' ' ' VAL . 3.3 p -89.09 105.26 15.73 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.693 0 O-C-N 121.325 -0.859 . . . . 0.0 110.006 179.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.604 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.3 p -64.39 153.05 39.73 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.252 -0.905 . . . . 0.0 110.557 -179.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -61.22 155.98 19.62 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.272 -0.892 . . . . 0.0 110.42 179.906 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . 0.587 ' HA ' HG22 ' B' ' 49' ' ' VAL . 26.8 m -68.17 128.48 36.7 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.382 -0.824 . . . . 0.0 110.343 179.792 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.608 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 49.7 p-90 -146.94 179.51 7.54 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.196 -0.94 . . . . 0.0 110.073 179.788 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.594 ' CG ' ' HA ' ' B' ' 46' ' ' SER . 36.4 t-80 -162.28 173.3 14.39 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.203 -0.936 . . . . 0.0 110.081 -179.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.536 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 98.0 m95 -79.18 125.19 29.12 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.142 -0.974 . . . . 0.0 110.009 179.95 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.652 HG22 ' O ' ' A' ' 31' ' ' VAL . 11.3 t -107.22 152.62 23.84 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.234 -0.916 . . . . 0.0 110.157 -179.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -169.51 177.15 43.22 Favored Glycine 0 N--CA 1.489 2.229 0 N-CA-C 109.396 -1.482 . . . . 0.0 109.396 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 52.1 m80 -64.5 -27.22 68.83 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.276 -1.132 . . . . 0.0 110.147 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 9.9 m120 -125.68 102.07 7.17 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.238 -0.914 . . . . 0.0 110.193 179.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 20.0 m -115.72 176.42 2.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.616 0 O-C-N 121.225 -0.922 . . . . 0.0 110.121 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 6.2 pttt -131.12 -174.69 3.46 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.248 -0.908 . . . . 0.0 110.21 179.975 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -52.24 -54.42 31.31 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.237 -0.914 . . . . 0.0 110.236 -179.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . 0.498 ' HE2' ' HE2' ' B' ' 8' ' ' LYS . 13.1 mtpt -53.26 115.38 1.87 Allowed 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.265 -0.897 . . . . 0.0 110.252 179.99 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.594 ' HA ' ' CG ' ' B' ' 36' ' ' HIS . 1.8 t -161.37 65.87 0.28 Allowed 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.27 -0.894 . . . . 0.0 109.989 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -169.05 115.1 0.59 Allowed 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.335 -0.853 . . . . 0.0 110.327 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.589 HG23 ' O ' ' B' ' 7' ' ' LEU . 62.8 mt -143.1 156.13 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.32 -0.862 . . . . 0.0 109.987 179.814 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.654 ' HB ' HD21 ' B' ' 7' ' ' LEU . 76.2 t -136.25 129.84 47.13 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.624 0 O-C-N 121.18 -0.95 . . . . 0.0 110.537 -179.812 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.504 ' OG1' ' NE2' ' B' ' 6' ' ' HIS . 87.1 m -94.01 149.78 20.93 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.367 -0.833 . . . . 0.0 109.873 179.714 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.542 HD12 HD23 ' B' ' 7' ' ' LEU . 0.5 OUTLIER -134.69 121.56 20.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.043 -1.036 . . . . 0.0 110.052 -179.952 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.617 ' CG2' HG22 ' B' ' 4' ' ' ILE . 0.0 OUTLIER -99.22 144.57 28.2 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.313 -0.867 . . . . 0.0 110.607 179.948 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.514 ' O ' HG23 ' B' ' 2' ' ' THR . 26.0 m-85 -124.62 157.09 36.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.268 -0.895 . . . . 0.0 109.893 179.616 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -84.0 -6.99 59.52 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.264 -0.898 . . . . 0.0 110.664 -179.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -162.57 157.81 22.57 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.101 -0.999 . . . . 0.0 110.354 -179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . 0.42 ' O ' ' HB3' ' B' ' 59' ' ' ARG . 57.9 mt-10 -70.16 -41.11 74.25 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.262 -0.899 . . . . 0.0 110.234 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . 0.409 ' O ' ' HG3' ' B' ' 61' ' ' GLN . 6.0 t90 -53.56 -52.55 59.37 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.246 -0.909 . . . . 0.0 110.093 179.826 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.452 ' O ' ' HB2' ' B' ' 61' ' ' GLN . 46.5 tt0 -59.28 -32.55 70.12 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.331 -0.855 . . . . 0.0 110.233 179.872 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.42 ' HB3' ' O ' ' B' ' 56' ' ' GLU . 3.7 ttm180 -59.11 -54.38 47.63 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.228 -0.92 . . . . 0.0 110.448 -179.868 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 25.9 t70 -61.15 -26.07 67.44 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.217 -0.927 . . . . 0.0 110.324 -179.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.452 ' HB2' ' O ' ' B' ' 58' ' ' GLN . 68.0 mt-30 -65.55 -54.28 30.24 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.207 -0.933 . . . . 0.0 110.229 179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.893 ' CZ ' HG21 ' B' ' 66' ' ' VAL . 7.1 t80 -55.91 -46.69 78.35 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.318 -0.864 . . . . 0.0 110.518 179.967 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.4 mt -59.31 -20.71 56.69 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.25 -0.906 . . . . 0.0 110.361 -179.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -92.55 -22.3 19.6 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.228 -0.92 . . . . 0.0 110.368 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 9.2 mm-40 -96.33 -22.0 17.46 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.22 -0.925 . . . . 0.0 110.023 -179.925 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.893 HG21 ' CZ ' ' B' ' 62' ' ' PHE . 60.7 t -97.22 107.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 O-C-N 121.341 -0.849 . . . . 0.0 110.341 -179.695 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -60.28 103.22 0.22 Allowed 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.283 -0.885 . . . . 0.0 109.855 179.803 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.613 HG23 ' CG2' ' B' ' 72' ' ' ILE . 40.1 mt -88.68 98.68 1.17 Allowed Pre-proline 0 N--CA 1.49 1.54 0 O-C-N 121.244 -0.91 . . . . 0.0 110.264 -179.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.477 ' HG2' HG12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -43.99 159.45 0.1 Allowed 'Trans proline' 0 C--N 1.305 -1.729 0 O-C-N 123.998 1.525 . . . . 0.0 110.277 179.96 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 20.9 mtmt -63.73 -13.84 47.08 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.22 -0.925 . . . . 0.0 110.263 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 20.3 p -84.64 -20.94 30.53 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.173 -0.955 . . . . 0.0 110.197 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.859 HD13 ' O ' ' B' ' 8' ' ' LYS . 6.8 mm -93.75 113.22 28.07 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.55 0 O-C-N 121.215 -0.928 . . . . 0.0 110.108 179.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.1 m -94.3 144.96 25.09 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.305 -0.872 . . . . 0.0 110.091 -179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . . . . . . . . . 1.4 p -90.54 171.57 1.09 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.568 0 O-C-N 121.296 -0.878 . . . . 0.0 110.973 -179.004 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . 0.588 ' CB ' ' HB2' ' B' ' 6' ' ' HIS . 0.6 OUTLIER -142.93 154.0 43.63 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.613 -0.68 . . . . 0.0 110.516 179.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 60.9 p -131.43 135.72 47.39 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.293 -0.88 . . . . 0.0 110.146 179.497 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.47 -170.89 34.54 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.578 -1.409 . . . . 0.0 109.578 -179.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.535 ' O ' ' O ' ' A' ' 78' ' ' PHE . 0.0 OUTLIER -147.69 143.64 27.77 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.253 -1.145 . . . . 0.0 109.964 179.965 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.4 mmm -135.7 155.64 50.08 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.951 -1.093 . . . . 0.0 110.742 -179.763 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -142.33 109.27 5.47 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.383 -0.823 . . . . 0.0 109.982 179.702 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 46.3 mt . . . . . 0 N--CA 1.492 1.63 0 CA-C-O 117.936 -1.03 . . . . 0.0 110.216 -179.907 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.451 ' CE ' ' HB3' ' A' ' 78' ' ' PHE . 3.5 mtp . . . . . 0 N--CA 1.492 1.652 0 CA-C-O 121.297 0.57 . . . . 0.0 110.307 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.39 108.67 61.95 Favored Pre-proline 0 N--CA 1.491 1.617 0 O-C-N 121.351 -0.843 . . . . 0.0 110.275 -179.966 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.511 ' O ' ' HA ' ' A' ' 52' ' ' THR . 51.9 Cg_endo -68.68 143.3 55.84 Favored 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.019 1.536 . . . . 0.0 110.047 179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.42 HG23 ' C ' ' A' ' 3' ' ' PRO . 3.0 pt -144.69 164.75 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.626 0 O-C-N 121.142 -0.974 . . . . 0.0 110.778 -179.873 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.404 ' CG2' ' HB2' ' A' ' 51' ' ' LEU . 17.1 m -144.54 147.05 19.7 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.541 -0.724 . . . . 0.0 109.497 179.729 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -105.71 127.91 53.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.047 -1.033 . . . . 0.0 110.687 -179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.948 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.2 OUTLIER -116.78 136.0 53.31 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.319 -0.863 . . . . 0.0 110.169 179.874 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.536 ' HG3' ' CG1' ' A' ' 48' ' ' ILE . 13.4 ttmt -140.12 164.47 29.97 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.221 -0.924 . . . . 0.0 110.26 -179.212 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 152.49 -174.95 31.29 Favored Glycine 0 N--CA 1.49 2.268 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.903 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.89 136.9 57.38 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.25 -1.147 . . . . 0.0 110.088 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . 0.778 ' HA ' HD12 ' A' ' 14' ' ' LEU . . . -49.97 -23.31 1.94 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.205 -0.934 . . . . 0.0 110.136 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 42.2 m-80 -68.95 -59.84 2.78 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.22 -0.925 . . . . 0.0 110.304 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.438 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 0.0 OUTLIER -57.96 -21.67 45.39 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.324 -0.86 . . . . 0.0 110.21 -179.901 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.778 HD12 ' HA ' ' A' ' 11' ' ' ALA . 17.9 mt -66.8 -45.57 77.95 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.303 -0.873 . . . . 0.0 110.443 -179.831 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 9.8 ttmt -59.93 -31.26 69.68 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.186 -0.947 . . . . 0.0 110.373 -179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.513 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 2.1 t -69.94 -41.75 74.15 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.237 -0.914 . . . . 0.0 110.545 -179.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.438 ' HG ' ' O ' ' A' ' 13' ' ' THR . 82.3 mt -58.96 -52.48 65.58 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.118 -0.989 . . . . 0.0 110.435 -179.762 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.498 ' O ' ' HB2' ' A' ' 21' ' ' PHE . 24.3 ttt-85 -48.89 -24.35 1.44 Allowed 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.299 -0.875 . . . . 0.0 110.525 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 9.8 t80 -64.54 -40.67 96.03 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.106 -0.996 . . . . 0.0 110.282 -179.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 69.5 mtm-85 -76.17 -15.53 60.04 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.173 -0.955 . . . . 0.0 110.029 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.586 ' CE2' HD21 ' A' ' 51' ' ' LEU . 3.7 m-30 -66.33 -30.9 71.41 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.251 -0.905 . . . . 0.0 109.836 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 6.5 mmtt -63.31 -33.96 76.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.236 -0.915 . . . . 0.0 109.883 179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 47.9 mmtt -74.89 -48.91 22.33 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.341 -0.85 . . . . 0.0 109.732 179.704 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.573 ' HB3' HD22 ' A' ' 27' ' ' LEU . 54.4 m-70 -95.27 28.51 2.84 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.333 -0.855 . . . . 0.0 109.761 179.585 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.714 ' SG ' HG23 ' A' ' 26' ' ' THR . 22.6 p -56.75 -22.02 32.53 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.269 -0.894 . . . . 0.0 110.027 179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.714 HG23 ' SG ' ' A' ' 25' ' ' CYS . 23.0 p -97.22 10.94 38.11 Favored 'General case' 0 N--CA 1.489 1.525 0 O-C-N 121.335 -0.853 . . . . 0.0 109.949 179.785 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.573 HD22 ' HB3' ' A' ' 24' ' ' HIS . 0.7 OUTLIER -92.1 -43.37 9.41 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.177 -0.952 . . . . 0.0 110.175 179.903 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.632 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 19.8 p90 -96.41 175.72 6.31 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.1 -1.0 . . . . 0.0 109.965 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.441 ' OG1' ' HB2' ' A' ' 54' ' ' ASP . 88.7 m -101.27 -34.44 9.64 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.081 -1.012 . . . . 0.0 111.349 -179.285 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.65 118.88 2.52 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.953 -1.092 . . . . 0.0 110.969 179.831 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.506 HG13 ' CE1' ' A' ' 28' ' ' TYR . 7.4 m -89.39 100.0 10.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.72 0 O-C-N 120.973 -1.08 . . . . 0.0 109.623 179.056 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.584 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 58.0 p -47.55 144.34 3.17 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.302 -0.874 . . . . 0.0 110.771 -179.414 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 19.1 p -61.86 164.92 5.81 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.228 -0.92 . . . . 0.0 109.948 179.656 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 56.9 m -68.03 120.5 14.36 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.117 -0.99 . . . . 0.0 110.142 179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.516 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 32.7 p-90 -146.52 -174.02 4.35 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.303 -0.873 . . . . 0.0 109.64 179.827 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.559 ' CG ' ' N ' ' A' ' 37' ' ' TRP . 28.2 t-80 -162.78 171.51 16.64 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 120.861 -1.149 . . . . 0.0 111.117 -179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.559 ' N ' ' CG ' ' A' ' 36' ' ' HIS . 22.0 m95 -78.74 93.76 4.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.472 -0.767 . . . . 0.0 110.151 -179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.469 ' O ' ' O ' ' B' ' 31' ' ' VAL . 4.0 t -175.1 163.89 3.24 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.193 -0.942 . . . . 0.0 110.339 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . 0.448 ' HA2' HG23 ' B' ' 31' ' ' VAL . . . -59.48 -114.92 0.01 OUTLIER Glycine 0 N--CA 1.491 2.359 0 N-CA-C 109.577 -1.409 . . . . 0.0 109.577 -179.926 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 18.5 p80 -128.65 -12.32 4.89 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.196 -1.179 . . . . 0.0 110.616 -179.83 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.635 ' O ' HG13 ' A' ' 42' ' ' VAL . 3.0 t-20 -141.01 127.41 19.87 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.123 -0.986 . . . . 0.0 110.385 -179.794 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.635 HG13 ' O ' ' A' ' 41' ' ' ASN . 0.1 OUTLIER -159.32 159.93 2.03 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.338 -0.851 . . . . 0.0 110.056 179.83 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 18.4 mttm -98.48 -27.6 13.99 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.27 -0.894 . . . . 0.0 110.463 -179.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 77.9 m-70 -57.55 167.8 0.96 Allowed 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.129 -0.982 . . . . 0.0 110.399 -179.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 84.4 mttt -125.57 122.48 36.63 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.286 -0.884 . . . . 0.0 110.026 -179.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.513 ' O ' HG13 ' A' ' 48' ' ' ILE . 5.5 p -164.94 34.33 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.029 -1.044 . . . . 0.0 110.682 -179.864 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -47.07 142.73 3.46 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.284 -0.885 . . . . 0.0 110.51 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.948 HG23 ' O ' ' A' ' 7' ' ' LEU . 63.3 mt -141.89 149.65 19.69 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 O-C-N 121.37 -0.831 . . . . 0.0 110.153 -179.774 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 40.4 t -120.2 121.32 65.44 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 O-C-N 121.275 -0.891 . . . . 0.0 110.814 -179.55 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.483 ' HB ' ' OG ' ' A' ' 32' ' ' SER . 33.2 m -93.73 148.95 21.64 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.329 -0.857 . . . . 0.0 109.131 178.981 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.586 HD21 ' CE2' ' A' ' 21' ' ' PHE . 0.4 OUTLIER -135.04 122.61 22.05 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.921 -1.112 . . . . 0.0 110.789 -179.348 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.511 ' HA ' ' O ' ' A' ' 3' ' ' PRO . 26.1 m -98.12 144.26 27.78 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.547 -0.721 . . . . 0.0 109.416 179.038 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.504 ' O ' ' HD2' ' A' ' 3' ' ' PRO . 55.2 m-85 -120.77 155.86 33.1 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.037 -1.039 . . . . 0.0 110.659 -179.654 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . 0.441 ' HB2' ' OG1' ' A' ' 29' ' ' THR . 2.9 t70 -78.16 -9.39 59.16 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.357 -0.839 . . . . 0.0 110.832 -179.29 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . 0.4 ' O ' ' C ' ' A' ' 56' ' ' GLU . 3.0 m -163.3 127.67 2.92 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.053 -1.029 . . . . 0.0 110.341 -179.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.4 ' C ' ' O ' ' A' ' 55' ' ' SER . 0.0 OUTLIER -45.28 -41.76 8.97 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.218 -0.926 . . . . 0.0 109.834 179.666 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.456 ' CE3' ' HA ' ' A' ' 57' ' ' TRP . 6.1 t-105 -54.05 -51.03 65.36 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.367 -0.833 . . . . 0.0 110.077 179.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.428 ' HA ' ' NE2' ' A' ' 61' ' ' GLN . 4.3 tp60 -58.35 -37.78 75.86 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.304 -0.873 . . . . 0.0 110.266 -179.641 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 46.4 ttp85 -59.14 -44.31 92.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.194 -0.941 . . . . 0.0 110.674 -179.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.15 -36.85 80.9 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.158 -0.964 . . . . 0.0 110.16 -179.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.428 ' NE2' ' HA ' ' A' ' 58' ' ' GLN . 37.8 mt-30 -65.68 -41.19 92.75 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.161 -0.962 . . . . 0.0 110.388 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.753 ' CZ ' HG11 ' A' ' 66' ' ' VAL . 23.5 t80 -55.96 -48.14 76.34 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.335 -0.853 . . . . 0.0 110.13 179.986 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 1.053 HD21 HG11 ' A' ' 74' ' ' VAL . 15.4 mt -59.09 -14.88 11.34 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.33 -0.857 . . . . 0.0 110.448 -179.815 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 18.7 p -99.98 -21.46 15.64 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.124 -0.985 . . . . 0.0 110.7 -179.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.539 HE22 HD21 ' A' ' 27' ' ' LEU . 31.6 mt-30 -94.13 -29.03 15.36 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.111 -0.993 . . . . 0.0 110.704 -178.837 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.753 HG11 ' CZ ' ' A' ' 62' ' ' PHE . 5.5 m -89.79 172.89 0.93 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.488 0 O-C-N 121.126 -0.984 . . . . 0.0 110.167 179.979 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -115.67 91.73 3.69 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.282 -0.887 . . . . 0.0 109.459 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.821 HG21 HG21 ' A' ' 74' ' ' VAL . 29.7 mm -88.64 107.48 17.31 Favored Pre-proline 0 N--CA 1.489 1.476 0 O-C-N 121.266 -0.896 . . . . 0.0 110.452 -179.499 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.966 ' HG2' HD12 ' A' ' 72' ' ' ILE . 43.9 Cg_endo -54.66 -169.08 0.02 OUTLIER 'Trans proline' 0 C--N 1.304 -1.764 0 O-C-N 124.002 1.528 . . . . 0.0 110.231 179.765 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -100.65 -6.77 24.69 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.265 -0.897 . . . . 0.0 110.294 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 44.8 p -84.71 -23.81 29.19 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.193 -0.942 . . . . 0.0 110.351 -179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.966 HD12 ' HG2' ' A' ' 69' ' ' PRO . 3.5 mt -94.2 135.42 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 121.279 -0.888 . . . . 0.0 110.439 -179.759 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 43.1 m -95.14 119.84 34.33 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.158 -0.964 . . . . 0.0 110.328 179.956 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 1.053 HG11 HD21 ' A' ' 63' ' ' LEU . 88.0 t -102.15 97.72 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.323 -0.86 . . . . 0.0 109.562 177.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 59.0 m -102.53 172.12 7.04 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 120.568 -1.333 . . . . 0.0 110.698 -179.68 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 63.3 p -111.96 177.28 4.7 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.333 -0.855 . . . . 0.0 109.747 179.445 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . 0.449 ' O ' ' CD1' ' A' ' 78' ' ' PHE . . . -179.25 179.06 48.93 Favored Glycine 0 N--CA 1.491 2.355 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.479 ' O ' ' O ' ' B' ' 78' ' ' PHE . 25.7 m-85 -147.75 136.87 22.23 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.33 -1.1 . . . . 0.0 110.124 -179.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . . . . . . . . . 2.5 mtp -119.94 172.61 7.6 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.116 -0.99 . . . . 0.0 110.408 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.19 100.96 7.49 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.294 -0.879 . . . . 0.0 109.725 179.662 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 14.1 tt . . . . . 0 N--CA 1.49 1.546 0 CA-C-O 118.118 -0.944 . . . . 0.0 110.404 -179.472 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.483 ' HE2' ' HB3' ' B' ' 78' ' ' PHE . 3.2 mtp . . . . . 0 N--CA 1.492 1.629 0 CA-C-O 121.175 0.512 . . . . 0.0 110.322 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . 0.411 ' O ' HG23 ' B' ' 4' ' ' ILE . 0.7 OUTLIER -105.98 108.27 61.3 Favored Pre-proline 0 N--CA 1.491 1.613 0 O-C-N 121.35 -0.844 . . . . 0.0 110.366 -179.916 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.507 ' O ' ' HA ' ' B' ' 52' ' ' THR . 50.7 Cg_endo -67.87 143.26 60.26 Favored 'Trans proline' 0 C--N 1.306 -1.699 0 O-C-N 123.917 1.483 . . . . 0.0 109.9 179.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.416 HG23 ' C ' ' B' ' 3' ' ' PRO . 2.8 pt -144.59 164.59 13.35 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.584 0 O-C-N 121.076 -1.015 . . . . 0.0 110.649 179.965 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.41 ' CG2' ' HB2' ' B' ' 51' ' ' LEU . 16.8 m -144.4 147.23 19.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.647 0 O-C-N 121.524 -0.735 . . . . 0.0 109.504 179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -105.84 128.2 53.59 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.995 -1.066 . . . . 0.0 110.53 -179.524 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.926 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.2 OUTLIER -117.24 135.59 53.69 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.366 -0.834 . . . . 0.0 109.954 179.892 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.519 ' HG3' ' CG1' ' B' ' 48' ' ' ILE . 14.4 ttmt -139.78 164.35 30.2 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.211 -0.931 . . . . 0.0 110.11 -179.161 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . . . . . . . . . . . 152.66 -175.7 31.14 Favored Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.701 -1.359 . . . . 0.0 109.701 -179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -64.79 136.39 56.85 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.322 -1.105 . . . . 0.0 110.127 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . 0.783 ' HA ' HD12 ' B' ' 14' ' ' LEU . . . -50.15 -21.75 1.43 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.341 -0.849 . . . . 0.0 110.456 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 41.9 m-80 -70.44 -58.99 3.12 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.203 -0.936 . . . . 0.0 110.024 -179.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.425 ' O ' ' HG ' ' B' ' 17' ' ' LEU . 0.0 OUTLIER -58.1 -22.27 49.95 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.352 -0.843 . . . . 0.0 110.238 179.926 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.783 HD12 ' HA ' ' B' ' 11' ' ' ALA . 18.8 mt -66.75 -45.49 78.42 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.232 -0.918 . . . . 0.0 110.568 -179.733 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 10.1 ttmt -59.79 -31.13 69.4 Favored 'General case' 0 N--CA 1.49 1.575 0 O-C-N 121.153 -0.967 . . . . 0.0 110.325 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.513 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 2.1 t -70.28 -41.74 73.02 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.399 -0.813 . . . . 0.0 110.682 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.425 ' HG ' ' O ' ' B' ' 13' ' ' THR . 83.2 mt -58.88 -52.69 64.65 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.018 -1.051 . . . . 0.0 110.333 -179.747 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . 0.511 ' O ' ' HB2' ' B' ' 21' ' ' PHE . 23.0 ttt-85 -48.68 -24.16 1.28 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.196 -0.94 . . . . 0.0 110.499 179.544 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.513 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 9.8 t80 -64.68 -40.62 95.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.025 -1.047 . . . . 0.0 110.316 -179.623 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 69.9 mtm-85 -76.28 -14.82 60.1 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.226 -0.921 . . . . 0.0 110.038 179.783 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.601 ' CE2' HD21 ' B' ' 51' ' ' LEU . 3.7 m-30 -66.57 -31.09 71.57 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.24 -0.913 . . . . 0.0 109.85 179.735 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 6.4 mmtt -63.38 -33.89 76.53 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.373 -0.829 . . . . 0.0 110.169 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 48.7 mmtt -74.85 -49.06 21.86 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.203 -0.936 . . . . 0.0 109.677 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.577 ' HB3' HD22 ' B' ' 27' ' ' LEU . 47.0 m-70 -94.9 28.79 2.59 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.378 -0.826 . . . . 0.0 109.748 179.549 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.731 ' SG ' HG23 ' B' ' 26' ' ' THR . 21.2 p -57.07 -21.8 34.4 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.356 -0.84 . . . . 0.0 109.759 -179.985 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.731 HG23 ' SG ' ' B' ' 25' ' ' CYS . 23.6 p -97.27 10.78 38.61 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.346 -0.846 . . . . 0.0 110.073 179.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.577 HD22 ' HB3' ' B' ' 24' ' ' HIS . 0.7 OUTLIER -92.16 -44.09 8.99 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.244 -0.91 . . . . 0.0 110.377 -179.968 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.636 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 20.8 p90 -95.82 175.44 6.51 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.095 -1.003 . . . . 0.0 109.837 179.823 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.436 ' OG1' ' HB2' ' B' ' 54' ' ' ASP . 80.7 m -100.95 -33.69 10.08 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.108 -0.995 . . . . 0.0 111.429 -179.343 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.75 118.82 2.48 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.049 -1.032 . . . . 0.0 110.972 -179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.533 HG13 ' CE1' ' B' ' 28' ' ' TYR . 8.1 m -89.43 99.84 9.93 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 O-C-N 120.93 -1.106 . . . . 0.0 109.649 179.074 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.516 ' HB2' ' CZ3' ' A' ' 35' ' ' TRP . 54.2 p -47.24 143.18 3.43 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.317 -0.865 . . . . 0.0 110.776 -179.517 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . 0.426 ' HA ' ' O ' ' A' ' 39' ' ' GLY . 14.1 p -61.62 164.48 5.94 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.348 -0.845 . . . . 0.0 109.907 179.486 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 65.8 m -68.04 121.02 15.24 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.114 -0.991 . . . . 0.0 110.345 -179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.584 ' CZ3' ' HB2' ' A' ' 32' ' ' SER . 31.2 p-90 -146.74 -173.43 4.21 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.341 -0.85 . . . . 0.0 109.539 179.768 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.549 ' CG ' ' N ' ' B' ' 37' ' ' TRP . 28.9 t-80 -162.89 171.25 16.91 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 120.852 -1.155 . . . . 0.0 110.917 -179.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.549 ' N ' ' CG ' ' B' ' 36' ' ' HIS . 26.9 m95 -78.79 93.63 5.0 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.504 -0.748 . . . . 0.0 110.045 179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . . . . . . . . . 3.9 t -174.17 167.11 4.17 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.211 -0.93 . . . . 0.0 110.438 179.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.58 -114.79 0.01 OUTLIER Glycine 0 N--CA 1.49 2.271 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 19.0 p80 -128.46 -12.47 4.99 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.192 -1.181 . . . . 0.0 110.583 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . 0.632 ' O ' HG13 ' B' ' 42' ' ' VAL . 3.0 t-20 -141.12 127.9 20.38 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.156 -0.965 . . . . 0.0 110.307 -179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.632 HG13 ' O ' ' B' ' 41' ' ' ASN . 0.1 OUTLIER -159.57 160.85 1.69 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.308 -0.87 . . . . 0.0 110.058 179.771 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . . . . . . . . . 18.3 mttm -99.36 -27.54 13.71 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.223 -0.923 . . . . 0.0 110.483 -179.738 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 78.4 m-70 -57.63 168.26 0.9 Allowed 'General case' 0 N--CA 1.491 1.594 0 O-C-N 121.243 -0.911 . . . . 0.0 110.338 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -126.22 122.91 36.92 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.36 -0.837 . . . . 0.0 110.065 179.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.506 ' O ' HG13 ' B' ' 48' ' ' ILE . 5.5 p -165.21 34.37 0.06 Allowed 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.133 -0.979 . . . . 0.0 110.43 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . . . . . . . . . . . -46.85 143.02 3.06 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.216 -0.928 . . . . 0.0 110.247 -179.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.926 HG23 ' O ' ' B' ' 7' ' ' LEU . 56.0 mt -141.87 150.29 19.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.551 0 O-C-N 121.171 -0.955 . . . . 0.0 110.098 -179.661 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 41.3 t -121.11 121.17 64.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.233 -0.917 . . . . 0.0 110.731 -179.505 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.471 ' HB ' ' OG ' ' B' ' 32' ' ' SER . 40.7 m -93.89 148.85 21.75 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.292 -0.88 . . . . 0.0 109.17 179.145 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . 0.601 HD21 ' CE2' ' B' ' 21' ' ' PHE . 0.4 OUTLIER -134.93 123.17 22.98 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.942 -1.099 . . . . 0.0 111.048 -179.417 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.507 ' HA ' ' O ' ' B' ' 3' ' ' PRO . 24.1 m -98.19 143.81 28.31 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.515 -0.741 . . . . 0.0 109.61 179.042 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.505 ' O ' ' HD2' ' B' ' 3' ' ' PRO . 58.4 m-85 -120.52 155.31 33.9 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.066 -1.021 . . . . 0.0 110.552 -179.779 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . 0.436 ' HB2' ' OG1' ' B' ' 29' ' ' THR . 3.0 t70 -77.69 -9.14 58.83 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.301 -0.874 . . . . 0.0 110.761 -179.419 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 3.2 m -163.28 128.06 3.0 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.128 -0.983 . . . . 0.0 110.493 -179.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -45.69 -41.54 10.58 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.345 -0.847 . . . . 0.0 109.794 179.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . 0.447 ' HA ' ' CE3' ' B' ' 57' ' ' TRP . 6.0 t-105 -54.26 -51.22 65.25 Favored 'General case' 0 N--CA 1.491 1.614 0 O-C-N 121.318 -0.864 . . . . 0.0 110.027 179.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.44 ' CA ' ' OE1' ' B' ' 58' ' ' GLN . 4.1 tp60 -58.21 -37.25 74.47 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.244 -0.91 . . . . 0.0 110.16 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 40.0 ttp85 -59.32 -44.84 92.54 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.091 -1.006 . . . . 0.0 110.609 -179.815 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -61.04 -36.87 80.69 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.157 -0.964 . . . . 0.0 110.286 -179.633 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.408 ' NE2' ' HA ' ' B' ' 58' ' ' GLN . 38.4 mt-30 -65.74 -41.08 92.62 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.292 -0.88 . . . . 0.0 110.29 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.786 ' CZ ' HG11 ' B' ' 66' ' ' VAL . 21.5 t80 -56.11 -48.28 76.48 Favored 'General case' 0 N--CA 1.491 1.616 0 O-C-N 121.348 -0.845 . . . . 0.0 110.223 179.883 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 1.057 HD21 HG11 ' B' ' 74' ' ' VAL . 15.0 mt -59.04 -14.2 8.92 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.357 -0.839 . . . . 0.0 110.277 -179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 17.8 p -100.54 -21.91 15.16 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.249 -0.907 . . . . 0.0 110.842 -179.75 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . 0.542 HE22 HD21 ' B' ' 27' ' ' LEU . 30.3 mt-30 -94.09 -28.67 15.58 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.026 -1.046 . . . . 0.0 110.596 -178.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.786 HG11 ' CZ ' ' B' ' 62' ' ' PHE . 5.5 m -89.57 173.13 0.91 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.033 -1.042 . . . . 0.0 110.028 179.744 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.14 92.63 3.95 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.219 -0.926 . . . . 0.0 109.28 179.869 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.803 HG21 HG21 ' B' ' 74' ' ' VAL . 30.2 mm -88.99 107.23 16.39 Favored Pre-proline 0 N--CA 1.489 1.523 0 O-C-N 121.366 -0.834 . . . . 0.0 110.438 -179.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.96 ' HG2' HD12 ' B' ' 72' ' ' ILE . 44.8 Cg_endo -54.18 -168.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.305 -1.756 0 O-C-N 124.034 1.544 . . . . 0.0 110.145 179.677 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -101.17 -6.52 24.17 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.138 -0.976 . . . . 0.0 110.411 -179.732 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 47.8 p -84.84 -23.54 29.0 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.268 -0.895 . . . . 0.0 110.382 -179.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.96 HD12 ' HG2' ' B' ' 69' ' ' PRO . 3.5 mt -94.15 135.23 29.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.652 0 O-C-N 121.258 -0.901 . . . . 0.0 110.416 -179.682 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 39.7 m -95.22 119.87 34.48 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.174 -0.954 . . . . 0.0 110.217 180.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 1.057 HG11 HD21 ' B' ' 63' ' ' LEU . 88.6 t -101.81 97.69 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 O-C-N 121.171 -0.956 . . . . 0.0 109.42 177.599 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 58.2 m -102.47 172.2 7.01 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.476 -1.39 . . . . 0.0 110.628 -179.626 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 72.8 p -112.53 176.34 5.06 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.401 -0.812 . . . . 0.0 109.823 179.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . 0.434 ' O ' ' CD1' ' B' ' 78' ' ' PHE . . . -178.45 179.44 48.64 Favored Glycine 0 N--CA 1.492 2.376 0 N-CA-C 109.837 -1.305 . . . . 0.0 109.837 179.782 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.483 ' HB3' ' HE2' ' B' ' 1' ' ' MET . 26.7 m-85 -147.57 137.35 22.79 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.246 -1.149 . . . . 0.0 110.194 179.875 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . . . . . . . . . 2.6 mtp -120.11 172.64 7.61 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.129 -0.982 . . . . 0.0 110.338 -179.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -120.78 100.97 7.41 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.305 -0.872 . . . . 0.0 109.73 179.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 14.0 tt . . . . . 0 N--CA 1.491 1.615 0 CA-C-O 117.971 -1.014 . . . . 0.0 110.191 -179.542 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.441 ' HE2' ' CD2' ' A' ' 78' ' ' PHE . 69.1 mtp . . . . . 0 N--CA 1.491 1.621 0 CA-C-O 121.188 0.518 . . . . 0.0 110.167 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 23.5 p -143.97 144.99 28.54 Favored Pre-proline 0 N--CA 1.491 1.577 0 O-C-N 121.253 -0.905 . . . . 0.0 110.272 179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.489 ' HD2' ' O ' ' A' ' 53' ' ' TYR . 51.7 Cg_endo -94.16 155.93 2.14 Favored 'Trans proline' 0 C--N 1.305 -1.751 0 O-C-N 124.047 1.551 . . . . 0.0 110.062 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.525 HD13 ' HG3' ' A' ' 79' ' ' MET . 11.4 pt -144.32 166.55 12.52 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 121.136 -0.977 . . . . 0.0 110.563 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.684 HG13 HG21 ' A' ' 74' ' ' VAL . 24.4 t -145.72 124.14 5.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.378 -0.827 . . . . 0.0 110.017 179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.501 ' O ' ' HA ' ' A' ' 74' ' ' VAL . 0.2 OUTLIER -105.69 110.57 22.92 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.234 -0.916 . . . . 0.0 110.274 -179.881 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.956 ' O ' HG23 ' A' ' 48' ' ' ILE . 1.7 tp -112.97 150.59 31.66 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.201 -0.937 . . . . 0.0 110.258 -179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.747 ' O ' HG23 ' A' ' 72' ' ' ILE . 8.5 ttpp -142.33 170.43 15.72 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.233 -0.917 . . . . 0.0 110.51 -179.607 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.473 ' O ' HD11 ' A' ' 14' ' ' LEU . . . 151.24 -179.87 27.54 Favored Glycine 0 N--CA 1.491 2.365 0 N-CA-C 109.593 -1.403 . . . . 0.0 109.593 179.903 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -65.04 137.12 57.5 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.276 -1.132 . . . . 0.0 110.217 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.32 -31.44 14.45 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.31 -0.869 . . . . 0.0 110.629 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -71.14 -55.1 8.88 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.224 -0.922 . . . . 0.0 110.765 -179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 5.1 m -57.85 -20.46 36.56 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.189 -0.945 . . . . 0.0 110.398 -179.603 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.473 HD11 ' O ' ' A' ' 9' ' ' GLY . 20.9 mt -90.34 -25.05 20.66 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.309 -0.87 . . . . 0.0 110.083 -179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 3.4 mmtp -58.88 -42.62 89.94 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.345 -0.847 . . . . 0.0 110.294 -179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.455 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 19.0 t -69.8 -34.5 73.8 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.425 -0.797 . . . . 0.0 110.435 -179.788 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.403 ' O ' ' N ' ' A' ' 19' ' ' TYR . 5.3 mp -58.85 -53.59 56.65 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.253 -0.904 . . . . 0.0 110.35 179.981 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -44.87 -22.97 0.1 Allowed 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.285 -0.884 . . . . 0.0 110.8 -179.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.455 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 85.7 t80 -64.57 -42.91 95.33 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.101 -0.999 . . . . 0.0 109.877 179.867 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 6.7 mtp85 -62.6 -27.44 69.2 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.317 -0.864 . . . . 0.0 109.969 179.827 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.526 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 9.4 m-30 -66.6 -16.86 64.49 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.375 -0.828 . . . . 0.0 110.264 179.962 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 26.3 mmtt -63.44 -56.11 18.86 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.241 -0.912 . . . . 0.0 109.804 179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.457 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 0.0 OUTLIER -75.27 -24.76 57.62 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.399 -0.813 . . . . 0.0 109.834 179.629 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.64 ' CA ' HD13 ' A' ' 27' ' ' LEU . 19.5 m170 -94.97 33.21 1.53 Allowed 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.397 -0.815 . . . . 0.0 110.015 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.499 ' HA ' ' CZ ' ' A' ' 28' ' ' TYR . 23.0 p -57.28 -23.79 50.66 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.315 -0.866 . . . . 0.0 110.349 -179.819 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . 0.473 HG22 ' H ' ' A' ' 26' ' ' THR . 2.7 t -97.28 13.52 29.21 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.194 -0.941 . . . . 0.0 110.687 -179.655 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.64 HD13 ' CA ' ' A' ' 24' ' ' HIS . 3.3 mp -92.31 -26.54 18.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.127 -0.983 . . . . 0.0 110.32 -179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.499 ' CZ ' ' HA ' ' A' ' 25' ' ' CYS . 34.8 p90 -118.39 167.89 11.14 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.12 -0.988 . . . . 0.0 110.034 179.794 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.494 ' N ' ' O ' ' A' ' 52' ' ' THR . 3.6 m -100.01 -34.24 10.17 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.127 -0.983 . . . . 0.0 110.457 -179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.569 ' HB3' ' OG1' ' A' ' 52' ' ' THR . . . -159.62 117.06 2.66 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.218 -0.926 . . . . 0.0 110.636 -179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.641 HG13 ' O ' ' B' ' 38' ' ' THR . 14.8 p -90.21 129.74 40.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 O-C-N 121.113 -0.992 . . . . 0.0 109.919 179.492 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.683 ' O ' HG13 ' A' ' 49' ' ' VAL . 2.0 t -87.4 148.1 25.15 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.159 -0.963 . . . . 0.0 110.235 179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 3.5 p -61.18 167.31 3.16 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.21 -0.931 . . . . 0.0 110.45 -179.803 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.02 121.07 15.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.281 -0.887 . . . . 0.0 110.538 -179.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.457 ' O ' ' N ' ' A' ' 48' ' ' ILE . 36.8 p-90 -146.93 175.47 10.64 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.247 -0.908 . . . . 0.0 109.847 179.619 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.516 ' HB3' ' HA ' ' A' ' 47' ' ' ALA . 15.2 p-80 -162.57 173.39 14.03 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.07 -1.019 . . . . 0.0 110.702 -179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.403 ' CZ3' ' HB2' ' B' ' 32' ' ' SER . 92.2 m95 -79.66 125.35 29.52 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.531 -0.73 . . . . 0.0 110.106 179.795 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . 0.515 ' O ' HG13 ' B' ' 31' ' ' VAL . 7.5 t -164.53 164.27 21.79 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.076 -1.015 . . . . 0.0 110.269 179.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -131.34 -66.35 0.09 OUTLIER Glycine 0 N--CA 1.49 2.279 0 N-CA-C 109.608 -1.397 . . . . 0.0 109.608 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -166.2 -48.66 0.03 OUTLIER 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.257 -1.143 . . . . 0.0 110.163 -179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -125.35 63.61 1.17 Allowed 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.227 -0.92 . . . . 0.0 110.138 -179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 18.7 m -134.39 154.72 37.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 121.342 -0.849 . . . . 0.0 110.079 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.428 ' O ' ' CG ' ' A' ' 43' ' ' LYS . 1.0 OUTLIER -53.88 130.4 37.13 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.206 -0.934 . . . . 0.0 110.166 -179.888 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 65.1 m80 -56.67 145.01 30.12 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.265 -0.897 . . . . 0.0 110.047 179.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -108.84 177.98 4.61 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.168 -0.958 . . . . 0.0 110.296 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.511 ' O ' HG13 ' A' ' 48' ' ' ILE . 15.1 m -84.36 116.54 23.08 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.248 -0.908 . . . . 0.0 110.254 179.987 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.516 ' HA ' ' HB3' ' A' ' 36' ' ' HIS . . . -35.9 152.2 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.683 -0.636 . . . . 0.0 110.679 -179.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.956 HG23 ' O ' ' A' ' 7' ' ' LEU . 46.3 mt -141.98 131.42 23.48 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.164 -0.96 . . . . 0.0 110.187 -179.537 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . 0.683 HG13 ' O ' ' A' ' 32' ' ' SER . 4.3 t -118.34 125.89 74.64 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.667 0 O-C-N 121.243 -0.911 . . . . 0.0 110.189 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.479 ' HA ' ' O ' ' A' ' 5' ' ' VAL . 88.0 m -93.82 157.43 16.14 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.221 -0.924 . . . . 0.0 110.094 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 9.6 mt -134.84 128.21 32.26 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.179 -0.951 . . . . 0.0 110.07 -179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.569 ' OG1' ' HB3' ' A' ' 30' ' ' ALA . 28.4 p -97.12 131.6 43.73 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.907 . . . . 0.0 110.239 -179.938 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.503 ' N ' ' CD1' ' A' ' 53' ' ' TYR . 48.6 m-85 -112.52 150.21 31.6 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.185 -0.947 . . . . 0.0 110.218 179.946 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -74.96 -7.65 54.2 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.191 -0.943 . . . . 0.0 110.221 -179.826 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 25.8 p -170.74 157.94 5.82 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.27 -0.894 . . . . 0.0 110.197 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -64.54 -37.64 88.27 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.325 -0.859 . . . . 0.0 110.354 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 8.3 t-105 -54.03 -53.59 50.98 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.155 -0.965 . . . . 0.0 110.324 -179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 57.6 tt0 -58.22 -35.46 71.71 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.299 -0.875 . . . . 0.0 110.44 -179.428 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.808 ' NH2' HG23 ' A' ' 76' ' ' THR . 22.4 ttt180 -58.91 -42.55 89.89 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.047 -1.033 . . . . 0.0 109.963 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.42 -34.8 76.0 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.283 -0.886 . . . . 0.0 110.489 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . . . . . . . . . 69.8 mt-30 -65.62 -45.5 82.85 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 121.185 -0.947 . . . . 0.0 110.466 -179.709 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.678 ' O ' HG13 ' A' ' 66' ' ' VAL . 3.0 t80 -55.96 -49.47 73.46 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.279 -0.888 . . . . 0.0 110.826 -179.669 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.572 ' HA ' HG22 ' A' ' 66' ' ' VAL . 97.6 mt -59.28 -46.06 89.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.266 -0.896 . . . . 0.0 110.765 -179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -65.1 -20.59 66.54 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.129 -0.982 . . . . 0.0 110.417 -179.709 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm-40 -95.81 -17.39 21.21 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.245 -0.91 . . . . 0.0 110.42 -179.642 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.727 ' O ' HG23 ' A' ' 66' ' ' VAL . 10.9 m -108.66 113.44 44.03 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 O-C-N 121.198 -0.939 . . . . 0.0 110.409 -179.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -70.52 115.62 9.9 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.186 -0.946 . . . . 0.0 110.064 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.639 HD11 HD11 ' A' ' 7' ' ' LEU . 4.2 tp -88.31 142.62 31.67 Favored Pre-proline 0 N--CA 1.487 1.409 0 O-C-N 121.194 -0.941 . . . . 0.0 110.207 -179.716 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.601 ' CG ' HD12 ' A' ' 72' ' ' ILE . 47.8 Cg_endo -94.72 162.4 1.81 Allowed 'Trans proline' 0 C--N 1.305 -1.762 0 O-C-N 124.034 1.544 . . . . 0.0 110.464 179.98 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 2.3 mttt -65.35 -16.76 63.93 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.227 -0.921 . . . . 0.0 110.347 -179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 45.3 m -84.68 -31.42 24.13 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.248 -0.907 . . . . 0.0 110.576 -179.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.747 HG23 ' O ' ' A' ' 8' ' ' LYS . 75.6 mt -93.51 148.94 4.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.587 0 O-C-N 121.096 -1.003 . . . . 0.0 110.641 -179.57 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 87.7 m -145.52 154.15 41.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.399 -0.813 . . . . 0.0 109.994 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.691 ' HB ' HD12 ' A' ' 7' ' ' LEU . 6.0 p -147.12 162.81 7.93 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 121.108 -0.995 . . . . 0.0 110.647 -179.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . 0.452 ' N ' HG22 ' A' ' 74' ' ' VAL . 0.1 OUTLIER -139.25 -179.63 5.98 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.439 -0.788 . . . . 0.0 109.997 -179.817 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.808 HG23 ' NH2' ' A' ' 59' ' ' ARG . 0.2 OUTLIER -108.08 167.72 9.8 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.159 -0.963 . . . . 0.0 110.354 -179.813 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.79 177.71 43.1 Favored Glycine 0 N--CA 1.491 2.326 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . 0.441 ' CD2' ' HE2' ' A' ' 1' ' ' MET . 0.1 OUTLIER -147.81 135.86 21.25 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.37 -1.077 . . . . 0.0 110.114 179.989 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.525 ' HG3' HD13 ' A' ' 4' ' ' ILE . 0.2 OUTLIER -117.87 153.86 32.82 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.253 -0.904 . . . . 0.0 110.269 -179.959 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 2.8 p -125.35 100.73 6.64 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.285 -0.884 . . . . 0.0 110.176 179.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 15.4 tt . . . . . 0 N--CA 1.492 1.646 0 CA-C-O 117.986 -1.007 . . . . 0.0 110.19 -179.966 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.425 ' SD ' ' CE2' ' B' ' 78' ' ' PHE . 71.3 mtp . . . . . 0 N--CA 1.493 1.712 0 CA-C-O 121.164 0.507 . . . . 0.0 110.081 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 29.2 p -145.34 143.39 20.09 Favored Pre-proline 0 N--CA 1.492 1.661 0 O-C-N 121.17 -0.956 . . . . 0.0 110.343 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.491 ' HD2' ' O ' ' B' ' 53' ' ' TYR . 50.8 Cg_endo -92.49 155.9 3.0 Favored 'Trans proline' 0 C--N 1.305 -1.717 0 O-C-N 124.068 1.562 . . . . 0.0 110.214 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.476 HD13 ' HG3' ' B' ' 79' ' ' MET . 11.2 pt -144.23 166.36 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 O-C-N 121.186 -0.946 . . . . 0.0 110.501 -179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.685 HG13 HG21 ' B' ' 74' ' ' VAL . 24.5 t -145.77 124.07 4.92 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.611 0 O-C-N 121.264 -0.898 . . . . 0.0 110.03 179.883 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.503 ' O ' ' HA ' ' B' ' 74' ' ' VAL . 0.2 OUTLIER -105.59 111.11 23.68 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.295 -0.878 . . . . 0.0 110.343 -179.984 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.952 ' O ' HG23 ' B' ' 48' ' ' ILE . 1.8 tp -113.32 150.13 32.97 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.315 -0.866 . . . . 0.0 110.138 -179.975 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.738 ' O ' HG23 ' B' ' 72' ' ' ILE . 8.5 ttpp -142.04 169.98 16.58 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.278 -0.889 . . . . 0.0 110.312 -179.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.472 ' O ' HD11 ' B' ' 14' ' ' LEU . . . 151.96 -179.98 28.08 Favored Glycine 0 N--CA 1.491 2.301 0 N-CA-C 109.574 -1.41 . . . . 0.0 109.574 179.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 72.5 m-20 -65.07 137.85 57.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.204 -1.174 . . . . 0.0 110.199 -179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.43 -31.9 16.32 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.262 -0.899 . . . . 0.0 110.573 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 2.5 t30 -70.92 -55.16 9.01 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.273 -0.892 . . . . 0.0 110.846 -179.454 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.404 ' O ' HD13 ' B' ' 17' ' ' LEU . 5.3 m -57.5 -20.96 34.7 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.179 -0.951 . . . . 0.0 110.391 -179.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . 0.472 HD11 ' O ' ' B' ' 9' ' ' GLY . 19.3 mt -90.15 -24.8 20.96 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.314 -0.866 . . . . 0.0 110.173 -179.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . . . . . . . . . 3.2 mmtp -58.91 -42.68 90.22 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.338 -0.851 . . . . 0.0 110.251 -179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.466 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 21.8 t -69.6 -34.98 74.87 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.417 -0.802 . . . . 0.0 110.36 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.404 HD13 ' O ' ' B' ' 13' ' ' THR . 5.5 mp -58.69 -53.64 56.13 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.271 -0.893 . . . . 0.0 110.343 -179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 34.2 ttp85 -44.59 -23.44 0.12 Allowed 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.217 -0.927 . . . . 0.0 110.728 -179.657 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.466 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 85.8 t80 -64.51 -43.43 94.09 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.022 -1.049 . . . . 0.0 109.852 -179.986 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 7.8 mtp85 -61.97 -27.51 68.9 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.391 -0.818 . . . . 0.0 109.987 179.689 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.493 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.6 m-30 -66.56 -16.99 64.57 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.283 -0.886 . . . . 0.0 110.268 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 26.6 mmtt -63.47 -56.07 19.06 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.204 -0.935 . . . . 0.0 109.806 179.894 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . 0.451 ' N ' ' HD3' ' B' ' 23' ' ' LYS . 0.0 OUTLIER -75.07 -24.91 58.27 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.272 -0.893 . . . . 0.0 109.875 179.61 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.65 ' CA ' HD13 ' B' ' 27' ' ' LEU . 18.7 m170 -94.93 32.89 1.57 Allowed 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.413 -0.805 . . . . 0.0 110.106 179.918 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.528 ' HA ' ' CZ ' ' B' ' 28' ' ' TYR . 24.8 p -57.19 -23.6 48.73 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.209 -0.932 . . . . 0.0 110.395 -179.877 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . 0.42 HG22 ' H ' ' B' ' 26' ' ' THR . 2.7 t -97.26 13.42 29.53 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.205 -0.934 . . . . 0.0 110.674 -179.724 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.65 HD13 ' CA ' ' B' ' 24' ' ' HIS . 3.2 mp -92.35 -26.39 18.1 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.066 -1.021 . . . . 0.0 110.42 179.961 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.528 ' CZ ' ' HA ' ' B' ' 25' ' ' CYS . 33.9 p90 -118.36 167.97 11.06 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.11 -0.994 . . . . 0.0 109.979 179.715 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.489 ' N ' ' O ' ' B' ' 52' ' ' THR . 3.7 m -100.29 -34.23 10.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.203 -0.936 . . . . 0.0 110.492 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . 0.558 ' HB3' ' OG1' ' B' ' 52' ' ' THR . . . -159.52 116.37 2.61 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.21 -0.931 . . . . 0.0 110.624 -179.881 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.515 HG13 ' O ' ' A' ' 38' ' ' THR . 14.5 p -90.02 129.89 40.19 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.155 -0.966 . . . . 0.0 110.005 179.465 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.693 ' O ' HG13 ' B' ' 49' ' ' VAL . 2.1 t -87.54 148.41 24.9 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.221 -0.924 . . . . 0.0 110.41 -179.813 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 4.5 p -61.07 166.99 3.21 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.287 -0.883 . . . . 0.0 110.413 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.99 120.77 14.79 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.287 -0.883 . . . . 0.0 110.423 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.479 ' CE3' ' OG ' ' A' ' 32' ' ' SER . 37.2 p-90 -146.58 175.26 10.72 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.224 -0.922 . . . . 0.0 109.932 179.644 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.509 ' HB3' ' HA ' ' B' ' 47' ' ' ALA . 16.7 p-80 -162.5 172.97 14.66 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.092 -1.005 . . . . 0.0 110.724 -179.832 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.429 ' CH2' HG23 ' A' ' 52' ' ' THR . 92.7 m95 -79.45 124.57 28.58 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.502 -0.749 . . . . 0.0 110.078 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.641 ' O ' HG13 ' A' ' 31' ' ' VAL . 7.0 t -163.8 164.95 23.44 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.256 -0.902 . . . . 0.0 110.318 179.97 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -132.37 -67.38 0.08 OUTLIER Glycine 0 N--CA 1.489 2.226 0 N-CA-C 109.505 -1.438 . . . . 0.0 109.505 179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -164.85 -49.9 0.03 OUTLIER 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.188 -1.183 . . . . 0.0 110.349 -179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -123.85 62.23 1.07 Allowed 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.144 -0.973 . . . . 0.0 110.379 -179.874 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 21.3 m -133.08 155.18 40.76 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 O-C-N 121.271 -0.893 . . . . 0.0 110.133 179.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.42 ' O ' ' CG ' ' B' ' 43' ' ' LYS . 1.0 OUTLIER -54.24 131.43 41.51 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.293 -0.879 . . . . 0.0 110.174 -179.919 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 66.5 m80 -57.44 144.95 34.59 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.277 -0.889 . . . . 0.0 110.122 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 1.9 tptm -108.25 178.26 4.55 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.147 -0.97 . . . . 0.0 110.276 -179.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.526 ' O ' HG13 ' B' ' 48' ' ' ILE . 15.0 m -84.75 116.33 23.19 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.28 -0.888 . . . . 0.0 110.221 179.845 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.509 ' HA ' ' HB3' ' B' ' 36' ' ' HIS . . . -35.64 151.85 0.01 OUTLIER 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.615 -0.678 . . . . 0.0 110.657 -179.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.952 HG23 ' O ' ' B' ' 7' ' ' LEU . 46.7 mt -142.06 130.31 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 O-C-N 121.376 -0.828 . . . . 0.0 110.101 -179.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . 0.693 HG13 ' O ' ' B' ' 32' ' ' SER . 4.2 t -117.34 125.96 74.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.286 -0.884 . . . . 0.0 110.177 -179.973 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.472 ' HA ' ' O ' ' B' ' 5' ' ' VAL . 88.0 m -93.79 157.5 16.11 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.278 -0.889 . . . . 0.0 110.147 -179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 9.4 mt -135.09 128.36 32.06 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.203 -0.936 . . . . 0.0 110.286 -179.87 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.558 ' OG1' ' HB3' ' B' ' 30' ' ' ALA . 30.7 p -97.22 132.2 43.21 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.279 -0.888 . . . . 0.0 110.276 179.977 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.498 ' CD1' ' N ' ' B' ' 53' ' ' TYR . 49.0 m-85 -113.01 150.36 32.04 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.288 -0.882 . . . . 0.0 110.021 179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 10.9 m-20 -75.13 -7.22 53.17 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.267 -0.895 . . . . 0.0 110.171 -179.882 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 24.9 p -170.72 157.72 5.75 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.317 -0.864 . . . . 0.0 110.283 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -64.46 -38.21 90.24 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.265 -0.897 . . . . 0.0 110.188 -179.961 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 8.5 t-105 -53.83 -53.72 48.5 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.363 -0.836 . . . . 0.0 110.447 -179.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . . . . . . . . . 58.2 tt0 -57.74 -35.43 70.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.256 -0.903 . . . . 0.0 110.473 -179.524 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.804 ' NH2' HG23 ' B' ' 76' ' ' THR . 23.3 ttt180 -58.94 -42.81 90.68 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.075 -1.016 . . . . 0.0 110.123 179.886 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -61.41 -34.48 75.45 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.322 -0.861 . . . . 0.0 110.333 179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . . . . . . . . . 70.4 mt-30 -65.77 -45.26 83.16 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.248 -0.908 . . . . 0.0 110.393 -179.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.652 ' O ' HG13 ' B' ' 66' ' ' VAL . 3.2 t80 -56.1 -49.66 73.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.281 -0.887 . . . . 0.0 110.763 -179.777 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.567 ' HA ' HG22 ' B' ' 66' ' ' VAL . 97.5 mt -59.22 -46.15 89.22 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.192 -0.942 . . . . 0.0 110.746 -179.355 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -65.18 -20.7 66.57 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.204 -0.935 . . . . 0.0 110.436 -179.737 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . . . . . . . . . 6.5 mm100 -95.7 -17.95 20.87 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.275 -0.89 . . . . 0.0 110.392 -179.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.718 HG23 ' O ' ' B' ' 66' ' ' VAL . 12.4 m -107.87 114.22 45.85 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.244 -0.91 . . . . 0.0 110.328 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -71.41 115.94 11.16 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.235 -0.916 . . . . 0.0 110.045 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.637 HD11 HD11 ' B' ' 7' ' ' LEU . 4.1 tp -88.07 143.65 33.33 Favored Pre-proline 0 N--CA 1.487 1.393 0 O-C-N 121.198 -0.939 . . . . 0.0 110.264 -179.752 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.587 ' CG ' HD12 ' B' ' 72' ' ' ILE . 47.0 Cg_endo -95.71 161.83 1.45 Allowed 'Trans proline' 0 C--N 1.305 -1.753 0 O-C-N 124.059 1.557 . . . . 0.0 110.344 179.904 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 2.5 mttt -65.23 -16.3 63.39 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.302 -0.874 . . . . 0.0 110.251 -179.953 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 40.7 m -84.88 -31.35 23.77 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.256 -0.903 . . . . 0.0 110.463 -179.804 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.738 HG23 ' O ' ' B' ' 8' ' ' LYS . 70.4 mt -93.65 148.83 4.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 O-C-N 121.157 -0.964 . . . . 0.0 110.599 -179.528 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 90.9 m -145.5 154.14 41.89 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.354 -0.842 . . . . 0.0 110.028 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.685 HG21 HG13 ' B' ' 5' ' ' VAL . 6.1 p -147.22 162.81 7.76 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 O-C-N 121.112 -0.992 . . . . 0.0 110.755 -179.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . 0.45 ' N ' HG22 ' B' ' 74' ' ' VAL . 0.1 OUTLIER -139.16 -179.86 6.1 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.375 -0.828 . . . . 0.0 109.955 -179.912 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . 0.804 HG23 ' NH2' ' B' ' 59' ' ' ARG . 0.2 OUTLIER -107.72 167.47 9.94 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.178 -0.951 . . . . 0.0 110.435 -179.906 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.24 177.5 42.88 Favored Glycine 0 N--CA 1.49 2.278 0 N-CA-C 109.637 -1.385 . . . . 0.0 109.637 -179.965 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . 0.425 ' CE2' ' SD ' ' B' ' 1' ' ' MET . 0.1 OUTLIER -147.73 135.95 21.42 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.26 -1.141 . . . . 0.0 110.111 179.96 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.476 ' HG3' HD13 ' B' ' 4' ' ' ILE . 0.2 OUTLIER -117.94 154.24 32.26 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.227 -0.921 . . . . 0.0 110.281 -179.911 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . . . . . . . . . 2.5 p -125.5 100.69 6.59 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.22 -0.925 . . . . 0.0 110.132 179.843 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . . . . . . . . . 15.1 tt . . . . . 0 N--CA 1.49 1.548 0 CA-C-O 118.015 -0.993 . . . . 0.0 110.25 -179.918 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.7 mtp . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 121.279 0.562 . . . . 0.0 110.298 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.37 160.46 25.96 Favored Pre-proline 0 N--CA 1.492 1.662 0 O-C-N 121.32 -0.863 . . . . 0.0 109.989 179.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PRO . . . . . 0.51 ' HG2' ' O ' ' A' ' 53' ' ' TYR . 51.8 Cg_endo -114.82 159.16 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.688 0 O-C-N 123.885 1.466 . . . . 0.0 110.09 179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 4.9 pt -144.49 164.37 13.62 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.573 0 O-C-N 121.169 -0.957 . . . . 0.0 110.221 -179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.443 HG21 ' CE1' ' A' ' 53' ' ' TYR . 97.8 t -145.94 127.64 8.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.59 0 O-C-N 121.27 -0.894 . . . . 0.0 109.906 179.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . 0.488 ' HB2' ' CE ' ' B' ' 79' ' ' MET . 0.1 OUTLIER -105.63 115.81 30.88 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.312 -0.867 . . . . 0.0 110.473 -179.673 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.912 ' O ' HG23 ' A' ' 48' ' ' ILE . 0.6 OUTLIER -118.53 149.76 40.77 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.382 -0.824 . . . . 0.0 109.909 179.766 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.721 ' O ' HG23 ' A' ' 72' ' ' ILE . 7.4 ttpt -142.72 171.89 13.44 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.043 -1.036 . . . . 0.0 110.637 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . 0.466 ' HA3' HG12 ' A' ' 72' ' ' ILE . . . 151.51 173.86 21.75 Favored Glycine 0 N--CA 1.491 2.352 0 N-CA-C 109.627 -1.389 . . . . 0.0 109.627 179.982 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 34.4 m-20 -64.99 138.23 58.23 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.16 -1.2 . . . . 0.0 110.056 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.29 -25.56 3.87 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.25 -0.906 . . . . 0.0 110.691 -179.762 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.478 ' O ' ' HB2' ' A' ' 15' ' ' LYS . 25.9 t30 -65.55 -61.36 2.14 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.163 -0.961 . . . . 0.0 110.598 -179.557 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' THR . . . . . 0.534 ' HB ' HD11 ' A' ' 72' ' ' ILE . 0.2 OUTLIER -57.87 -32.47 67.71 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.101 -0.999 . . . . 0.0 110.338 -179.769 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 85.6 mt -67.75 -30.29 69.72 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.238 -0.914 . . . . 0.0 110.01 179.964 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LYS . . . . . 0.478 ' HB2' ' O ' ' A' ' 12' ' ' ASN . 10.0 mmtp -59.99 -45.61 92.14 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.216 -0.928 . . . . 0.0 110.149 179.838 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.531 ' O ' ' HB3' ' A' ' 19' ' ' TYR . 5.7 t -70.08 -36.56 75.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.472 -0.767 . . . . 0.0 110.739 -179.526 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.7 mp -58.9 -56.69 19.0 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.899 -1.125 . . . . 0.0 110.668 -179.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 13.0 ttp85 -47.08 -21.33 0.22 Allowed 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.294 -0.879 . . . . 0.0 110.676 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.531 ' HB3' ' O ' ' A' ' 16' ' ' CYS . 91.0 t80 -64.27 -27.25 68.91 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.006 -1.059 . . . . 0.0 109.818 -179.97 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mtt85 -79.6 -31.9 41.8 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 121.264 -0.898 . . . . 0.0 109.882 179.563 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . 0.557 ' CD1' ' N ' ' A' ' 21' ' ' PHE . 8.8 m-30 -66.33 -14.93 62.79 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.32 -0.863 . . . . 0.0 110.101 179.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 9.9 mmpt? -63.43 -55.67 22.38 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.284 -0.885 . . . . 0.0 110.115 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.494 ' HD3' ' N ' ' A' ' 23' ' ' LYS . 1.8 mptt -75.18 -22.7 57.84 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.308 -0.87 . . . . 0.0 110.192 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.664 ' HB3' HD22 ' A' ' 27' ' ' LEU . 11.3 m170 -95.04 38.93 1.11 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.264 -0.897 . . . . 0.0 110.172 179.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' CYS . . . . . 0.516 ' HA ' ' CE1' ' A' ' 28' ' ' TYR . 25.1 p -57.0 -25.43 58.51 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.243 -0.911 . . . . 0.0 110.358 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 14.8 t -97.49 11.34 37.13 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.268 -0.895 . . . . 0.0 110.76 -179.731 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.664 HD22 ' HB3' ' A' ' 24' ' ' HIS . 3.0 mp -92.33 -32.41 15.0 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.083 -1.011 . . . . 0.0 110.355 -179.925 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.516 ' CE1' ' HA ' ' A' ' 25' ' ' CYS . 50.6 p90 -113.38 171.74 7.38 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.189 -0.945 . . . . 0.0 109.615 179.512 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.48 ' HB ' ' O ' ' A' ' 52' ' ' THR . 61.7 m -101.16 -36.22 9.03 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.056 -1.028 . . . . 0.0 111.064 -179.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.4 122.54 3.22 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.023 -1.048 . . . . 0.0 110.798 -179.947 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.683 ' O ' HG13 ' A' ' 31' ' ' VAL . 11.0 p -88.16 108.16 18.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.162 -0.961 . . . . 0.0 109.891 179.725 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . 0.54 ' HB2' ' CZ3' ' B' ' 35' ' ' TRP . 0.3 OUTLIER -63.46 146.55 53.4 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.423 -0.798 . . . . 0.0 110.99 -179.403 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . 0.443 ' HB3' ' CG2' ' B' ' 38' ' ' THR . 36.3 p -61.58 163.41 7.05 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.403 -0.811 . . . . 0.0 110.258 179.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -68.16 115.62 7.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.321 -0.862 . . . . 0.0 110.647 -179.913 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TRP . . . . . 0.58 ' CB ' ' HB3' ' B' ' 35' ' ' TRP . 16.5 p-90 -146.92 168.66 20.92 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.267 -0.896 . . . . 0.0 110.091 179.782 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.546 ' N ' ' CE3' ' A' ' 35' ' ' TRP . 14.2 p-80 -162.47 178.48 8.57 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.004 -1.06 . . . . 0.0 110.775 179.923 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . 0.633 ' CH2' HG23 ' B' ' 52' ' ' THR . 80.4 m95 -79.73 125.18 29.33 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.551 -0.718 . . . . 0.0 110.467 179.93 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 7.1 t -164.8 152.54 11.65 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.232 -0.918 . . . . 0.0 110.271 179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -112.48 -88.73 1.77 Allowed Glycine 0 N--CA 1.49 2.256 0 N-CA-C 109.499 -1.44 . . . . 0.0 109.499 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' HIS . . . . . . . . . . . . . 81.7 t60 -157.64 -42.14 0.07 Allowed 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.211 -1.17 . . . . 0.0 110.127 179.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.24 56.06 1.12 Allowed 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.283 -0.886 . . . . 0.0 110.201 179.863 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.439 HG23 ' N ' ' A' ' 43' ' ' LYS . 4.1 m -131.17 -157.17 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.265 -0.897 . . . . 0.0 110.179 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LYS . . . . . 0.482 ' O ' ' HG3' ' A' ' 43' ' ' LYS . 18.2 pttt -95.67 130.85 42.43 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.181 -0.949 . . . . 0.0 110.283 -179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 29.5 m80 -53.4 145.48 14.35 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.194 -0.941 . . . . 0.0 110.072 179.885 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -114.81 146.3 41.19 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.166 -0.959 . . . . 0.0 110.294 179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . 0.444 ' O ' ' C ' ' A' ' 47' ' ' ALA . 65.5 m -57.96 116.97 3.83 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.277 -0.889 . . . . 0.0 110.253 -179.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.48 ' C ' HG13 ' A' ' 48' ' ' ILE . . . -38.81 158.07 0.01 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.553 -0.717 . . . . 0.0 110.165 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.912 HG23 ' O ' ' A' ' 7' ' ' LEU . 45.7 mt -140.83 131.34 27.64 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.501 0 O-C-N 121.271 -0.893 . . . . 0.0 110.262 -179.147 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 52.9 t -110.48 117.18 54.27 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 O-C-N 121.308 -0.87 . . . . 0.0 110.691 -179.528 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.41 ' O ' ' HB3' ' A' ' 32' ' ' SER . 96.2 m -94.14 153.81 17.91 Favored 'General case' 0 N--CA 1.491 1.586 0 O-C-N 121.21 -0.931 . . . . 0.0 109.626 179.476 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 3.8 mp -136.31 131.2 34.05 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 120.931 -1.106 . . . . 0.0 110.497 -179.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.664 HG23 ' CH2' ' B' ' 37' ' ' TRP . 7.6 p -97.34 135.07 39.77 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.394 -0.816 . . . . 0.0 110.042 179.66 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.51 ' O ' ' HG2' ' A' ' 3' ' ' PRO . 88.8 m-85 -111.23 148.75 32.16 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.136 -0.978 . . . . 0.0 110.396 -179.922 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 40.2 m-20 -81.97 -8.79 59.69 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.213 -0.93 . . . . 0.0 110.151 -179.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.94 138.45 6.87 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.334 -0.854 . . . . 0.0 110.196 -179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -54.79 -39.2 68.18 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.252 -0.905 . . . . 0.0 110.266 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.77 -51.74 62.45 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.201 -0.937 . . . . 0.0 110.164 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.524 ' NE2' ' O ' ' A' ' 27' ' ' LEU . 51.3 tt0 -57.12 -40.79 77.8 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.359 -0.838 . . . . 0.0 110.743 -178.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -59.18 -36.87 76.1 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.036 -1.04 . . . . 0.0 110.392 179.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 14.5 t70 -61.08 -44.5 97.27 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.2 -0.937 . . . . 0.0 110.947 -179.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLN . . . . . 0.507 ' O ' ' HG2' ' A' ' 65' ' ' GLN . 47.8 mt-30 -65.61 -39.0 91.06 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.124 -0.985 . . . . 0.0 110.619 -179.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.648 ' O ' HG22 ' A' ' 66' ' ' VAL . 3.0 t80 -54.85 -48.21 73.19 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.163 -0.961 . . . . 0.0 110.221 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 91.5 mt -59.8 -25.95 65.36 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.191 -0.943 . . . . 0.0 110.163 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -80.78 -20.41 42.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.299 -0.875 . . . . 0.0 110.628 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' GLN . . . . . 0.507 ' HG2' ' O ' ' A' ' 61' ' ' GLN . 9.1 mm-40 -96.18 -20.58 18.48 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.159 -0.963 . . . . 0.0 110.418 179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.648 HG22 ' O ' ' A' ' 62' ' ' PHE . 32.2 m -103.24 118.96 51.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.6 0 O-C-N 121.247 -0.908 . . . . 0.0 110.413 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 7.7 tttm -78.31 114.09 16.88 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.125 -0.984 . . . . 0.0 110.175 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.439 HD11 HD11 ' A' ' 7' ' ' LEU . 3.5 tp -88.52 137.42 30.52 Favored Pre-proline 0 N--CA 1.489 1.49 0 O-C-N 121.296 -0.878 . . . . 0.0 110.053 179.961 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HD2' ' HB ' ' A' ' 72' ' ' ILE . 46.7 Cg_endo -98.82 159.95 0.68 Allowed 'Trans proline' 0 C--N 1.306 -1.676 0 O-C-N 123.894 1.47 . . . . 0.0 110.329 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -59.82 -13.04 8.8 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.238 -0.914 . . . . 0.0 110.157 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 94.5 m -84.28 -38.01 20.99 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.265 -0.897 . . . . 0.0 110.028 179.822 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.721 HG23 ' O ' ' A' ' 8' ' ' LYS . 72.4 mt -93.97 149.48 4.33 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.167 -0.958 . . . . 0.0 110.314 -179.989 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 23.4 m -144.9 153.82 41.97 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.235 -0.915 . . . . 0.0 110.029 179.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.737 ' HB ' HD12 ' A' ' 7' ' ' LEU . 3.3 p -146.54 159.47 10.49 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.151 -0.968 . . . . 0.0 110.664 -179.457 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.54 -179.36 5.86 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.386 -0.821 . . . . 0.0 110.164 -179.865 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . . . . . . . . . 1.4 m -107.93 170.88 7.72 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.177 -0.952 . . . . 0.0 110.719 -179.567 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.37 -178.57 40.72 Favored Glycine 0 N--CA 1.493 2.481 0 N-CA-C 109.633 -1.387 . . . . 0.0 109.633 -179.99 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -148.1 138.0 22.53 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.237 -1.155 . . . . 0.0 110.246 -179.985 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' MET . . . . . 0.537 ' CE ' ' HB2' ' B' ' 6' ' ' HIS . 0.9 OUTLIER -121.06 170.71 9.27 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.243 -0.911 . . . . 0.0 110.092 179.847 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' SER . . . . . 0.422 ' O ' ' OG ' ' A' ' 80' ' ' SER . 1.3 p -137.73 103.92 5.15 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.211 -0.931 . . . . 0.0 110.408 179.896 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.541 ' O ' ' CG1' ' A' ' 81' ' ' ILE . 0.7 OUTLIER . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 118.114 -0.946 . . . . 0.0 109.976 179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 64.8 mtp . . . . . 0 N--CA 1.491 1.577 0 CA-C-O 121.27 0.557 . . . . 0.0 110.36 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -105.67 160.96 24.27 Favored Pre-proline 0 N--CA 1.492 1.633 0 O-C-N 121.297 -0.877 . . . . 0.0 110.063 179.767 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . 0.515 ' HG2' ' O ' ' B' ' 53' ' ' TYR . 49.9 Cg_endo -115.53 158.95 0.03 OUTLIER 'Trans proline' 0 C--N 1.306 -1.687 0 O-C-N 123.894 1.471 . . . . 0.0 110.04 179.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.404 ' C ' HG23 ' B' ' 5' ' ' VAL . 5.0 pt -144.49 164.01 13.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 O-C-N 121.281 -0.887 . . . . 0.0 110.367 -179.904 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' VAL . . . . . 0.469 HG21 ' CE1' ' B' ' 53' ' ' TYR . 98.0 t -145.84 127.62 8.29 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.66 0 O-C-N 121.298 -0.876 . . . . 0.0 109.955 179.69 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' HIS . . . . . 0.537 ' HB2' ' CE ' ' A' ' 79' ' ' MET . 0.1 OUTLIER -105.47 116.1 31.37 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.232 -0.917 . . . . 0.0 110.537 -179.642 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.893 ' O ' HG23 ' B' ' 48' ' ' ILE . 0.6 OUTLIER -118.56 149.69 40.91 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.317 -0.865 . . . . 0.0 109.779 179.652 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' LYS . . . . . 0.743 ' O ' HG23 ' B' ' 72' ' ' ILE . 7.3 ttpt -142.43 172.31 12.86 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.076 -1.015 . . . . 0.0 110.461 -179.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' GLY . . . . . 0.474 ' HA3' HG12 ' B' ' 72' ' ' ILE . . . 150.82 174.1 21.5 Favored Glycine 0 N--CA 1.49 2.258 0 N-CA-C 109.394 -1.482 . . . . 0.0 109.394 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' ASP . . . . . . . . . . . . . 36.5 m-20 -65.08 138.55 58.39 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.152 -1.205 . . . . 0.0 110.252 -179.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -50.47 -25.16 3.68 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.252 -0.905 . . . . 0.0 110.655 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' ASN . . . . . 0.475 ' O ' ' HB2' ' B' ' 15' ' ' LYS . 26.4 t30 -66.54 -61.49 1.96 Allowed 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.239 -0.913 . . . . 0.0 110.692 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' THR . . . . . 0.522 ' HB ' HD11 ' B' ' 72' ' ' ILE . 0.2 OUTLIER -57.77 -31.72 66.79 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.053 -1.029 . . . . 0.0 110.388 -179.841 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' LEU . . . . . . . . . . . . . 84.7 mt -68.24 -30.55 69.62 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.184 -0.947 . . . . 0.0 110.008 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' LYS . . . . . 0.475 ' HB2' ' O ' ' B' ' 12' ' ' ASN . 10.2 mmtp -59.65 -45.45 91.97 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.174 -0.954 . . . . 0.0 110.19 179.89 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' CYS . . . . . 0.536 ' O ' ' HB3' ' B' ' 19' ' ' TYR . 5.8 t -70.09 -36.25 74.77 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.881 -179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.411 ' HA ' HD12 ' B' ' 17' ' ' LEU . 1.6 mp -58.94 -56.91 16.22 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.978 -1.076 . . . . 0.0 110.648 -179.592 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' ARG . . . . . . . . . . . . . 12.9 ttp85 -47.1 -21.43 0.24 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.263 -0.898 . . . . 0.0 110.655 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' TYR . . . . . 0.536 ' HB3' ' O ' ' B' ' 16' ' ' CYS . 91.5 t80 -64.19 -27.23 68.92 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.072 -1.017 . . . . 0.0 109.759 -179.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' ARG . . . . . . . . . . . . . 1.6 mtt85 -79.77 -31.66 40.92 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.354 -0.841 . . . . 0.0 109.836 179.509 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . 0.554 ' CD1' ' N ' ' B' ' 21' ' ' PHE . 9.4 m-30 -66.44 -15.01 63.0 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.289 -0.882 . . . . 0.0 110.068 179.866 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' LYS . . . . . . . . . . . . . 10.0 mmpt? -63.36 -55.94 20.4 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.365 -0.834 . . . . 0.0 110.2 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . 0.497 ' N ' ' HD3' ' B' ' 23' ' ' LYS . 1.7 mptt -75.05 -22.59 58.29 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.216 -0.928 . . . . 0.0 110.252 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' HIS . . . . . 0.676 ' HB3' HD22 ' B' ' 27' ' ' LEU . 12.8 m170 -95.01 38.63 1.12 Allowed 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.279 -0.888 . . . . 0.0 110.173 179.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' CYS . . . . . 0.555 ' HA ' ' CE1' ' B' ' 28' ' ' TYR . 25.1 p -57.13 -25.45 58.89 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.183 -0.948 . . . . 0.0 110.521 -179.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' THR . . . . . . . . . . . . . 14.9 t -97.57 11.37 37.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.191 -0.943 . . . . 0.0 110.615 -179.715 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' LEU . . . . . 0.676 HD22 ' HB3' ' B' ' 24' ' ' HIS . 3.3 mp -92.3 -32.23 15.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.136 -0.978 . . . . 0.0 110.32 -179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' TYR . . . . . 0.555 ' CE1' ' HA ' ' B' ' 25' ' ' CYS . 50.2 p90 -113.49 172.06 7.19 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.236 -0.915 . . . . 0.0 109.665 179.587 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' THR . . . . . 0.475 ' HB ' ' O ' ' B' ' 52' ' ' THR . 57.3 m -101.49 -36.37 8.84 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.035 -1.04 . . . . 0.0 111.065 -179.77 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' ALA . . . . . . . . . . . . . . . -160.39 122.46 3.21 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.043 -1.035 . . . . 0.0 110.913 -179.902 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' VAL . . . . . 0.678 ' O ' HG13 ' B' ' 31' ' ' VAL . 11.1 p -88.15 109.57 19.93 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.276 -0.89 . . . . 0.0 109.816 179.805 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . 0.565 ' HB2' ' CZ3' ' A' ' 37' ' ' TRP . 0.3 OUTLIER -64.88 146.87 54.32 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.427 -0.796 . . . . 0.0 111.173 -179.254 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' SER . . . . . . . . . . . . . 78.4 p -61.41 163.06 7.09 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.373 -0.83 . . . . 0.0 110.081 179.519 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.25 115.77 8.09 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.338 -0.851 . . . . 0.0 110.512 179.958 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' TRP . . . . . 0.58 ' HB3' ' CB ' ' A' ' 35' ' ' TRP . 17.7 p-90 -146.99 168.97 20.2 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.126 -0.984 . . . . 0.0 110.13 179.773 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . 0.518 ' N ' ' CE3' ' B' ' 35' ' ' TRP . 12.7 p-80 -162.6 178.54 8.46 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.103 -0.998 . . . . 0.0 110.734 179.934 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' TRP . . . . . 0.664 ' CH2' HG23 ' A' ' 52' ' ' THR . 79.5 m95 -79.72 125.05 29.16 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.487 -0.758 . . . . 0.0 110.218 179.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' THR . . . . . 0.443 ' CG2' ' HB3' ' A' ' 33' ' ' SER . 6.8 t -164.42 151.56 11.57 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.313 -0.867 . . . . 0.0 110.254 -179.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' GLY . . . . . . . . . . . . . . . -111.88 -89.0 1.84 Allowed Glycine 0 N--CA 1.49 2.28 0 N-CA-C 109.436 -1.466 . . . . 0.0 109.436 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' HIS . . . . . . . . . . . . . 82.4 t60 -157.51 -42.2 0.07 Allowed 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.329 -1.101 . . . . 0.0 110.207 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -122.53 55.55 1.16 Allowed 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.282 -0.886 . . . . 0.0 110.255 -179.894 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.46 HG23 ' N ' ' B' ' 43' ' ' LYS . 4.3 m -130.32 -155.55 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.593 0 O-C-N 121.212 -0.93 . . . . 0.0 110.239 179.963 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' LYS . . . . . 0.47 ' O ' ' HG3' ' B' ' 43' ' ' LYS . 18.4 pttt -97.21 131.49 43.89 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.285 -0.884 . . . . 0.0 110.217 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' HIS . . . . . . . . . . . . . 30.1 m80 -53.84 145.18 16.64 Favored 'General case' 0 N--CA 1.49 1.533 0 O-C-N 121.328 -0.857 . . . . 0.0 110.187 179.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' LYS . . . . . . . . . . . . . 1.6 tptt -114.72 145.42 42.08 Favored 'General case' 0 N--CA 1.49 1.536 0 O-C-N 121.364 -0.835 . . . . 0.0 110.324 -179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . 0.444 ' O ' ' O ' ' B' ' 47' ' ' ALA . 55.8 m -57.32 116.8 3.53 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.253 -0.904 . . . . 0.0 110.212 179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' ALA . . . . . 0.487 ' C ' HG13 ' B' ' 48' ' ' ILE . . . -39.02 158.52 0.01 OUTLIER 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.411 -0.806 . . . . 0.0 110.091 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . 0.893 HG23 ' O ' ' B' ' 7' ' ' LEU . 44.2 mt -140.74 131.89 29.05 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.451 0 O-C-N 121.208 -0.932 . . . . 0.0 110.2 -179.134 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' VAL . . . . . . . . . . . . . 53.7 t -111.11 116.64 53.04 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 O-C-N 121.21 -0.931 . . . . 0.0 110.53 -179.548 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' THR . . . . . 0.414 ' O ' ' HB3' ' B' ' 32' ' ' SER . 98.2 m -93.72 154.03 18.02 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.269 -0.894 . . . . 0.0 109.535 179.397 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . 3.7 mp -136.17 131.44 34.65 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.978 -1.076 . . . . 0.0 110.54 -179.759 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' THR . . . . . 0.633 HG23 ' CH2' ' A' ' 37' ' ' TRP . 9.1 p -97.62 135.3 39.64 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.273 -0.892 . . . . 0.0 110.028 179.686 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.515 ' O ' ' HG2' ' B' ' 3' ' ' PRO . 91.1 m-85 -111.46 148.7 32.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.085 -1.009 . . . . 0.0 110.354 -179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -82.46 -8.65 59.61 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.14 -0.975 . . . . 0.0 110.045 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -162.16 138.34 7.73 Favored 'General case' 0 N--CA 1.491 1.591 0 O-C-N 121.214 -0.929 . . . . 0.0 110.147 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -55.25 -39.25 69.55 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.339 -0.851 . . . . 0.0 110.169 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' TRP . . . . . . . . . . . . . 2.5 t-105 -53.71 -52.06 61.27 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.271 -0.893 . . . . 0.0 110.14 179.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' GLN . . . . . 0.512 ' NE2' ' O ' ' B' ' 27' ' ' LEU . 52.1 tt0 -57.07 -41.04 78.03 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.411 -0.805 . . . . 0.0 110.751 -179.136 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 5.1 ttt180 -59.02 -36.2 74.56 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 120.977 -1.077 . . . . 0.0 110.267 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -61.65 -44.96 95.99 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.272 -0.893 . . . . 0.0 110.984 -179.697 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' GLN . . . . . 0.508 ' O ' ' HG2' ' B' ' 65' ' ' GLN . 47.5 mt-30 -65.42 -38.55 90.28 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.119 -0.988 . . . . 0.0 110.599 -179.334 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' PHE . . . . . 0.632 ' O ' HG22 ' B' ' 66' ' ' VAL . 4.0 t80 -54.85 -48.18 73.23 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.225 -0.922 . . . . 0.0 110.145 -179.728 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 91.9 mt -59.64 -25.79 64.97 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.215 -0.928 . . . . 0.0 110.388 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -81.22 -20.42 41.11 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.325 -0.859 . . . . 0.0 110.505 -179.691 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' GLN . . . . . 0.508 ' HG2' ' O ' ' B' ' 61' ' ' GLN . 8.9 mm-40 -96.4 -19.31 19.29 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.116 -0.99 . . . . 0.0 110.286 -179.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' VAL . . . . . 0.632 HG22 ' O ' ' B' ' 62' ' ' PHE . 30.1 m -104.9 118.38 52.16 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 121.2 -0.937 . . . . 0.0 110.232 -179.951 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -77.94 114.51 16.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.314 -0.866 . . . . 0.0 110.268 -179.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' ILE . . . . . 0.438 HD11 HD11 ' B' ' 7' ' ' LEU . 3.3 tp -88.74 137.26 30.19 Favored Pre-proline 0 N--CA 1.488 1.434 0 O-C-N 121.228 -0.92 . . . . 0.0 110.151 179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' PRO . . . . . 0.459 ' HD2' ' HB ' ' B' ' 72' ' ' ILE . 47.8 Cg_endo -98.43 160.25 0.76 Allowed 'Trans proline' 0 C--N 1.303 -1.832 0 O-C-N 123.911 1.48 . . . . 0.0 110.212 179.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.03 -12.95 9.31 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 121.16 -0.962 . . . . 0.0 110.12 179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' THR . . . . . . . . . . . . . 87.1 m -84.49 -38.24 20.34 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.265 -0.897 . . . . 0.0 110.118 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' ILE . . . . . 0.743 HG23 ' O ' ' B' ' 8' ' ' LYS . 78.9 mt -93.81 149.76 4.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.219 -0.925 . . . . 0.0 110.229 -179.947 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' THR . . . . . . . . . . . . . 23.4 m -144.87 153.87 42.04 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.33 -0.857 . . . . 0.0 110.147 179.937 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' VAL . . . . . 0.718 ' HB ' HD12 ' B' ' 7' ' ' LEU . 3.3 p -146.4 159.66 10.74 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.557 0 O-C-N 121.179 -0.95 . . . . 0.0 110.642 -179.466 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -139.76 -179.55 6.0 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.418 -0.801 . . . . 0.0 110.04 -179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' THR . . . . . . . . . . . . . 1.5 m -107.8 170.93 7.69 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.081 -1.012 . . . . 0.0 110.715 -179.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' GLY . . . . . . . . . . . . . . . -169.5 -178.91 41.02 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.648 -1.381 . . . . 0.0 109.648 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -147.79 138.18 23.02 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.267 -1.137 . . . . 0.0 110.34 -179.946 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' MET . . . . . 0.488 ' CE ' ' HB2' ' A' ' 6' ' ' HIS . 0.5 OUTLIER -121.4 170.46 9.62 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.379 -0.825 . . . . 0.0 110.053 -179.993 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' SER . . . . . 0.493 ' O ' ' OG ' ' B' ' 80' ' ' SER . 1.3 p -137.64 104.24 5.26 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.17 -0.956 . . . . 0.0 110.341 179.998 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' ILE . . . . . 0.55 ' CG1' ' O ' ' B' ' 81' ' ' ILE . 0.6 OUTLIER . . . . . 0 N--CA 1.492 1.648 0 O-C-N 121.126 -0.984 . . . . 0.0 109.965 179.912 . . . . . . . . 2 2 . 1 stop_ save_